jackkuo commited on
Commit
9c11685
·
verified ·
1 Parent(s): db26a8d

Add files using upload-large-folder tool

Browse files
This view is limited to 50 files because it contains too many changes.   See raw diff
Files changed (50) hide show
  1. .gitattributes +57 -0
  2. 0NAzT4oBgHgl3EQfRPtW/content/2301.01212v1.pdf +3 -0
  3. 0NAzT4oBgHgl3EQfRPtW/vector_store/index.pkl +3 -0
  4. 19E2T4oBgHgl3EQf5QiW/vector_store/index.pkl +3 -0
  5. 19FLT4oBgHgl3EQfqS-c/content/tmp_files/2301.12139v1.pdf.txt +1036 -0
  6. 19FLT4oBgHgl3EQfqS-c/content/tmp_files/load_file.txt +0 -0
  7. 1tE1T4oBgHgl3EQflQSM/vector_store/index.faiss +3 -0
  8. 3NAzT4oBgHgl3EQfuf1J/content/tmp_files/2301.01691v1.pdf.txt +1040 -0
  9. 3NAzT4oBgHgl3EQfuf1J/content/tmp_files/load_file.txt +0 -0
  10. 3NFKT4oBgHgl3EQf8S4-/vector_store/index.faiss +3 -0
  11. 3tE0T4oBgHgl3EQfeADx/content/tmp_files/load_file.txt +0 -0
  12. 4tE3T4oBgHgl3EQfQQmX/content/2301.04411v1.pdf +3 -0
  13. 4tE3T4oBgHgl3EQfQQmX/vector_store/index.pkl +3 -0
  14. 5NE4T4oBgHgl3EQf1Q0a/content/tmp_files/2301.05288v1.pdf.txt +2964 -0
  15. 5NE4T4oBgHgl3EQf1Q0a/content/tmp_files/load_file.txt +0 -0
  16. 5dE1T4oBgHgl3EQfmgRl/vector_store/index.pkl +3 -0
  17. 6dE0T4oBgHgl3EQffAAW/vector_store/index.faiss +3 -0
  18. 9dE0T4oBgHgl3EQffwCf/content/2301.02409v1.pdf +3 -0
  19. 9dE0T4oBgHgl3EQffwCf/vector_store/index.pkl +3 -0
  20. 9tE0T4oBgHgl3EQfwwGF/content/tmp_files/2301.02637v1.pdf.txt +2147 -0
  21. 9tE0T4oBgHgl3EQfwwGF/content/tmp_files/load_file.txt +0 -0
  22. 9tE1T4oBgHgl3EQf8AWv/content/tmp_files/2301.03541v1.pdf.txt +646 -0
  23. 9tE1T4oBgHgl3EQf8AWv/content/tmp_files/load_file.txt +0 -0
  24. ANAzT4oBgHgl3EQf_v-e/content/tmp_files/2301.01953v1.pdf.txt +1582 -0
  25. ANAzT4oBgHgl3EQf_v-e/content/tmp_files/load_file.txt +0 -0
  26. ANE4T4oBgHgl3EQfEgyT/content/2301.04878v1.pdf +3 -0
  27. ANE4T4oBgHgl3EQfEgyT/vector_store/index.faiss +3 -0
  28. ANE4T4oBgHgl3EQfEgyT/vector_store/index.pkl +3 -0
  29. C9FQT4oBgHgl3EQf_jdA/vector_store/index.faiss +3 -0
  30. CtE4T4oBgHgl3EQfeg0W/content/2301.05099v1.pdf +3 -0
  31. CtE4T4oBgHgl3EQfeg0W/vector_store/index.pkl +3 -0
  32. ENE2T4oBgHgl3EQf9wlw/content/tmp_files/2301.04231v1.pdf.txt +845 -0
  33. ENE2T4oBgHgl3EQf9wlw/content/tmp_files/load_file.txt +0 -0
  34. GtE4T4oBgHgl3EQfHgy3/content/2301.04904v1.pdf +3 -0
  35. GtE4T4oBgHgl3EQfHgy3/vector_store/index.faiss +3 -0
  36. GtE4T4oBgHgl3EQfHgy3/vector_store/index.pkl +3 -0
  37. J9E3T4oBgHgl3EQfvQsy/content/2301.04691v1.pdf +3 -0
  38. J9E3T4oBgHgl3EQfvQsy/vector_store/index.faiss +3 -0
  39. J9E5T4oBgHgl3EQfXw8r/content/tmp_files/2301.05568v1.pdf.txt +1906 -0
  40. J9E5T4oBgHgl3EQfXw8r/content/tmp_files/load_file.txt +0 -0
  41. K9E2T4oBgHgl3EQfVQcE/content/2301.03820v1.pdf +3 -0
  42. K9E2T4oBgHgl3EQfVQcE/vector_store/index.faiss +3 -0
  43. K9E2T4oBgHgl3EQfVQcE/vector_store/index.pkl +3 -0
  44. K9FRT4oBgHgl3EQf1Th-/content/2301.13656v1.pdf +3 -0
  45. K9FRT4oBgHgl3EQfEDfx/content/2301.13475v1.pdf +3 -0
  46. K9FRT4oBgHgl3EQfEDfx/vector_store/index.faiss +3 -0
  47. K9FRT4oBgHgl3EQfEDfx/vector_store/index.pkl +3 -0
  48. KtAyT4oBgHgl3EQfTvdX/content/tmp_files/2301.00111v1.pdf.txt +551 -0
  49. KtAyT4oBgHgl3EQfTvdX/content/tmp_files/load_file.txt +0 -0
  50. KtE0T4oBgHgl3EQfSQDq/vector_store/index.faiss +3 -0
.gitattributes CHANGED
@@ -5747,3 +5747,60 @@ ytAyT4oBgHgl3EQfn_gd/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -tex
5747
  ldE1T4oBgHgl3EQfgwR3/content/2301.03233v1.pdf filter=lfs diff=lfs merge=lfs -text
5748
  8NFLT4oBgHgl3EQfsy_c/content/2301.12149v1.pdf filter=lfs diff=lfs merge=lfs -text
5749
  TdAzT4oBgHgl3EQfJfuh/content/2301.01081v1.pdf filter=lfs diff=lfs merge=lfs -text
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
5747
  ldE1T4oBgHgl3EQfgwR3/content/2301.03233v1.pdf filter=lfs diff=lfs merge=lfs -text
5748
  8NFLT4oBgHgl3EQfsy_c/content/2301.12149v1.pdf filter=lfs diff=lfs merge=lfs -text
5749
  TdAzT4oBgHgl3EQfJfuh/content/2301.01081v1.pdf filter=lfs diff=lfs merge=lfs -text
5750
+ TdAzT4oBgHgl3EQfJfuh/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5751
+ Y9FLT4oBgHgl3EQfVi9P/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5752
+ K9FRT4oBgHgl3EQf1Th-/content/2301.13656v1.pdf filter=lfs diff=lfs merge=lfs -text
5753
+ Y9E0T4oBgHgl3EQf3wL_/content/2301.02731v1.pdf filter=lfs diff=lfs merge=lfs -text
5754
+ J9E3T4oBgHgl3EQfvQsy/content/2301.04691v1.pdf filter=lfs diff=lfs merge=lfs -text
5755
+ udE3T4oBgHgl3EQfkQqh/content/2301.04596v1.pdf filter=lfs diff=lfs merge=lfs -text
5756
+ 0NAzT4oBgHgl3EQfRPtW/content/2301.01212v1.pdf filter=lfs diff=lfs merge=lfs -text
5757
+ cdE4T4oBgHgl3EQfPwyZ/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5758
+ K9FRT4oBgHgl3EQfEDfx/content/2301.13475v1.pdf filter=lfs diff=lfs merge=lfs -text
5759
+ NtAzT4oBgHgl3EQfzP6J/content/2301.01766v1.pdf filter=lfs diff=lfs merge=lfs -text
5760
+ V9E0T4oBgHgl3EQf3AJU/content/2301.02719v1.pdf filter=lfs diff=lfs merge=lfs -text
5761
+ s9E5T4oBgHgl3EQfmQ_T/content/2301.05678v1.pdf filter=lfs diff=lfs merge=lfs -text
5762
+ ldE1T4oBgHgl3EQfgwR3/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5763
+ K9E2T4oBgHgl3EQfVQcE/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5764
+ 6dE0T4oBgHgl3EQffAAW/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5765
+ K9FRT4oBgHgl3EQfEDfx/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5766
+ K9E2T4oBgHgl3EQfVQcE/content/2301.03820v1.pdf filter=lfs diff=lfs merge=lfs -text
5767
+ edFKT4oBgHgl3EQfAS1-/content/2301.11698v1.pdf filter=lfs diff=lfs merge=lfs -text
5768
+ bdAyT4oBgHgl3EQfXPdL/content/2301.00178v1.pdf filter=lfs diff=lfs merge=lfs -text
5769
+ fNFJT4oBgHgl3EQfTywB/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5770
+ 9dE0T4oBgHgl3EQffwCf/content/2301.02409v1.pdf filter=lfs diff=lfs merge=lfs -text
5771
+ edFKT4oBgHgl3EQfAS1-/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5772
+ fdAyT4oBgHgl3EQfxPkj/content/2301.00661v1.pdf filter=lfs diff=lfs merge=lfs -text
5773
+ 3NFKT4oBgHgl3EQf8S4-/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5774
+ 4tE3T4oBgHgl3EQfQQmX/content/2301.04411v1.pdf filter=lfs diff=lfs merge=lfs -text
5775
+ ANE4T4oBgHgl3EQfEgyT/content/2301.04878v1.pdf filter=lfs diff=lfs merge=lfs -text
5776
+ fNFJT4oBgHgl3EQfTywB/content/2301.11505v1.pdf filter=lfs diff=lfs merge=lfs -text
5777
+ KtE0T4oBgHgl3EQfSQDq/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5778
+ NtAzT4oBgHgl3EQfzP6J/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5779
+ ANE4T4oBgHgl3EQfEgyT/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5780
+ hNE1T4oBgHgl3EQfzQVT/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5781
+ s9E5T4oBgHgl3EQfmQ_T/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5782
+ N9FRT4oBgHgl3EQfHDeZ/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5783
+ uNE1T4oBgHgl3EQf3wXV/content/2301.03494v1.pdf filter=lfs diff=lfs merge=lfs -text
5784
+ h9E1T4oBgHgl3EQfMwOA/content/2301.02993v1.pdf filter=lfs diff=lfs merge=lfs -text
5785
+ fdFAT4oBgHgl3EQf7x7c/content/2301.08747v1.pdf filter=lfs diff=lfs merge=lfs -text
5786
+ PtAzT4oBgHgl3EQfzv6c/content/2301.01774v1.pdf filter=lfs diff=lfs merge=lfs -text
5787
+ GtE4T4oBgHgl3EQfHgy3/content/2301.04904v1.pdf filter=lfs diff=lfs merge=lfs -text
5788
+ Z9FLT4oBgHgl3EQfWi9I/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5789
+ 1tE1T4oBgHgl3EQflQSM/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5790
+ UtE4T4oBgHgl3EQfMQxc/content/2301.04945v1.pdf filter=lfs diff=lfs merge=lfs -text
5791
+ CtE4T4oBgHgl3EQfeg0W/content/2301.05099v1.pdf filter=lfs diff=lfs merge=lfs -text
5792
+ C9FQT4oBgHgl3EQf_jdA/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5793
+ fdFAT4oBgHgl3EQf7x7c/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5794
+ QtFJT4oBgHgl3EQf3C0d/content/2301.11658v1.pdf filter=lfs diff=lfs merge=lfs -text
5795
+ J9E3T4oBgHgl3EQfvQsy/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5796
+ bdAyT4oBgHgl3EQfXPdL/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5797
+ atFPT4oBgHgl3EQfADR0/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5798
+ Y9FLT4oBgHgl3EQfVi9P/content/2301.12053v1.pdf filter=lfs diff=lfs merge=lfs -text
5799
+ Z9FLT4oBgHgl3EQfWi9I/content/2301.12057v1.pdf filter=lfs diff=lfs merge=lfs -text
5800
+ GtE4T4oBgHgl3EQfHgy3/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5801
+ UtE4T4oBgHgl3EQfMQxc/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5802
+ QtFJT4oBgHgl3EQf3C0d/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5803
+ eNFQT4oBgHgl3EQfjzbM/content/2301.13356v1.pdf filter=lfs diff=lfs merge=lfs -text
5804
+ MNFRT4oBgHgl3EQf2ji4/content/2301.13661v1.pdf filter=lfs diff=lfs merge=lfs -text
5805
+ LNE0T4oBgHgl3EQfzwJL/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
5806
+ ltAyT4oBgHgl3EQfk_i4/vector_store/index.faiss filter=lfs diff=lfs merge=lfs -text
0NAzT4oBgHgl3EQfRPtW/content/2301.01212v1.pdf ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:956b1deaa853f6dd9197c24870828334cc66f45cbfdf455437db475c13cfa36c
3
+ size 162629
0NAzT4oBgHgl3EQfRPtW/vector_store/index.pkl ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:b8c7416161849310b67521d5257fa3cc3948ee28ab7ca32579ce53d746283482
3
+ size 80732
19E2T4oBgHgl3EQf5QiW/vector_store/index.pkl ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:987b683425672216d5bf5df17248551db2dc40d217f51b648b83216d628a8afa
3
+ size 92303
19FLT4oBgHgl3EQfqS-c/content/tmp_files/2301.12139v1.pdf.txt ADDED
@@ -0,0 +1,1036 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Bipol: Multi-axes Evaluation of Bias with
2
+ Explainability in Benchmark Datasets
3
+ Tosin Adewumi∗‡, Isabella S¨odergren†, Lama Alkhaled‡, Sana Sabah Sabry‡, Foteini Liwicki‡
4
+ and Marcus Liwicki‡
5
+ Machine Learning Group, EISLAB,
6
+ Lule˚a University of Technology, Sweden
7
+ ∗corresponding author, †isasde-5@student.ltu.se, ‡firstname.lastname@ltu.se
8
+ Abstract—We evaluate five English NLP benchmark datasets
9
+ (available on the superGLUE leaderboard) for bias, along mul-
10
+ tiple axes. The datasets are the following: Boolean Question
11
+ (Boolq), CommitmentBank (CB), Winograd Schema Challenge
12
+ (WSC), Winogender diagnostic (AXg), and Recognising Textual
13
+ Entailment (RTE). Bias can be harmful and it is known to be
14
+ common in data, which ML models learn from. In order to
15
+ mitigate bias in data, it is crucial to be able to estimate it
16
+ objectively. We use bipol, a novel multi-axes bias metric with
17
+ explainability, to quantify and explain how much bias exists in
18
+ these datasets. Multilingual, multi-axes bias evaluation is not very
19
+ common. Hence, we also contribute a new, large labelled Swedish
20
+ bias-detection dataset, with about 2 million samples; translated
21
+ from the English version. In addition, we contribute new multi-
22
+ axes lexica for bias detection in Swedish. We train a SotA model
23
+ on the new dataset for bias detection. We make the codes, model,
24
+ and new dataset publicly available.
25
+ Index Terms—bias, explainability, bipol, dataset, nlp
26
+ I. INTRODUCTION
27
+ Bias, which can be harmful [1], is the unfair prejudice in
28
+ favor of or against a thing, person or group, relative to another
29
+ [2]. Measuring bias in text data can be challenging because of
30
+ the axes that may be involved (e.g. religious or gender bias).
31
+ Bipol was introduced by [3]. It is a metric that estimates bias
32
+ along multiple axes in text data and provides an explanation
33
+ for its scores.
34
+ In this work, we investigate and estimate social bias in some
35
+ of the benchmark datasets for NLP, particularly those available
36
+ on the English SuperGLUE leaderboard. The SuperGLUE
37
+ was introduced by [4] and provides benchmark datasets for
38
+ different NLP tasks. Benchmark datasets are datasets for
39
+ comparing the performance of algorithms for specific use-
40
+ cases. [5], [6]. Such datasets have been the foundation for
41
+ some of the significant advancements in the field [6]. We
42
+ investigate the following datasets: Boolq, CB, WSC, AXg, and
43
+ RTE.
44
+ Classification accuracy is known to drop with attempts at
45
+ mitigating biases in data [7]–[9] yet it is important to estimate
46
+ and mitigate them because of the ethical implications or harm
47
+ that may arise for the disadvantaged, sensitive group [10], [11],
48
+ thereby affecting the data quality. Some characteristics of bias
49
+ in text data are:1
50
+ • It is heavily lopsided.
51
+ 1https://libguides.uwgb.edu/bias
52
+ • It uses inappropriate language.
53
+ • It is based on unsubstantiated claims.
54
+ a) Our
55
+ contributions:
56
+ We
57
+ show
58
+ quantitatively
59
+ and
60
+ through explainability that bias exists in the datasets. This
61
+ will provide researchers with insight into how to mitigate
62
+ bias in text data and possibly add impetus to the conversation
63
+ on whether it is even ethical to remove these social biases
64
+ from the training data, because they represent the real world.
65
+ Furthermore, we provide, possibly, the largest labelled dataset
66
+ and lexica for bias detection in Swedish (multi-axes bias
67
+ dataset (MAB)-Swedish) and train a model based on the state-
68
+ of-the-art (SotA) Swedish BERT [12]. We release our codes
69
+ publicly.2
70
+ The rest of this paper is structured as follows: Section II
71
+ describes materials used and our methods, including details of
72
+ the characteristics of bipol and the new MAB-Swedish dataset.
73
+ Section III describes the results and discusses the types of bias
74
+ in the datasets. Section IV discusses some of the previous
75
+ related work. In Section V, we conclude our work.
76
+ II. MATERIALS & METHODS
77
+ A. Bipol
78
+ There are two stages in the implementation of bipol (see
79
+ 1a [3]) before it gives a final score between 0.0 (zero or un-
80
+ detected bias) and 1.0 (extreme bias). The first stage involves
81
+ the classification of the data samples (into biased and unbiased
82
+ categories) using a trained model (see 1b). It is the ratio of
83
+ the number of biased samples (true positives (tp) and false
84
+ positives (fp)) to the total samples (true positives (tp), false
85
+ positives (fp), true negatives (tn), and false negatives (fn)).
86
+ Ideally, a good classifier should minimize the number of fp
87
+ and maximize the number of tp.
88
+ The second stage evaluates the biased samples for sensitive
89
+ terms listed in the multi-axes lexica (see 1c). It involves finding
90
+ the difference between the two maximum summed frequencies
91
+ in the types of an axis (| �n
92
+ s=1 as − �m
93
+ s=1 bs|), which is then
94
+ divided by the summed frequencies of all the terms in that axis
95
+ (�p
96
+ s=1 ds). The average over all the axes ( 1
97
+ q
98
+ �q
99
+ x=1) using this
100
+ operation is then averaged over all the biased samples ( 1
101
+ r
102
+ �r
103
+ t=1
104
+ ). Table I provides the Swedish lexica sizes. The lexica are
105
+ 2github.com/tosingithub/Bipol
106
+ arXiv:2301.12139v1 [cs.CL] 28 Jan 2023
107
+
108
+ derived from [13], [14] and Wikipedia3 and may be expanded
109
+ as needed. The English lexica contain more and are derived
110
+ from public sources [3].
111
+ b = bc.bs
112
+ (1a)
113
+ bc =
114
+ tp + fp
115
+ tp + fp + tn + fn
116
+ (1b)
117
+ bs = 1
118
+ r
119
+ r
120
+
121
+ t=1
122
+
123
+ 1
124
+ q
125
+ q
126
+
127
+ x=1
128
+ �| �n
129
+ s=1 as − �m
130
+ s=1 bs|
131
+ �p
132
+ s=1 ds
133
+
134
+ x
135
+
136
+ t
137
+ (1c)
138
+ TABLE I
139
+ SWEDISH LEXICA SIZES. THESE MAY BE EXPANDED.
140
+ Axis
141
+ Axis type 1
142
+ Axis type 2
143
+ Gender
144
+ 17 (female)
145
+ 19 (male)
146
+ Racial
147
+ 10 (black)
148
+ 10 (white)
149
+ The rationale for using bipol is because of the strengths
150
+ of the metric. These include 1) the relative simplicity of
151
+ calculating a score, 2) it is straight-forward to implement since
152
+ it is based on existing concepts like lexica and classifiers, 3)
153
+ it captures semantic and term frequency (TF) aspects of data,
154
+ and 4) it is not limited in the total number of axes that may
155
+ be used. We acknowledge, however, that it has limitations that
156
+ are based on the limitations of the tools that may be used to
157
+ calculate it.
158
+ B. Datasets
159
+ The new MAB-Swedish dataset: The dataset was machine-
160
+ translated (from MAB [3]) using the Helsinki-NLP model
161
+ [15], which was mostly trained with guided alignment. The
162
+ automatic translation took over 48 hours on one GPU. The
163
+ features in the two datasets are, hence, the same. It has
164
+ 1,946,975 samples, as given in Table II. The English version
165
+ was constructed from two datasets: Jigsaw4 and the Social
166
+ Bias Inference Corpus v2 (SBICv2) by [16]. The Jigsaw
167
+ (a multipurpose dataset) and the SBICv2 assume that bias
168
+ correlates with toxicity. The samples with toxicity equal to
169
+ or above the threshold of 0.1 were automatically labelled
170
+ as biased and those below were labelled as unbiased. Some
171
+ examples in the MAB-Swedish are given in Table III.
172
+ TABLE II
173
+ MAB-SWEDISH & MAB DATASETS SPLIT
174
+ Set
175
+ Biased
176
+ Unbiased
177
+ Total
178
+ Training
179
+ 533,544
180
+ 1,209,433
181
+ 1,742,977
182
+ Validation
183
+ 32338
184
+ 69649
185
+ 101987
186
+ Test
187
+ 33470
188
+ 68541
189
+ 102011
190
+ 599,352
191
+ 1,347,623
192
+ 1,946,975
193
+ 3en.wikipedia.org/wiki/Swedish profanity
194
+ 4medium.com/jigsaw/creating-labeled-datasets-and-exploring-the-role-of-
195
+ human-raters-56367b6db298
196
+ TABLE III
197
+ EXAMPLES FROM THE MAB-SWEDISH (THE ENGLISH IN THE ORIGINAL
198
+ IS IN ITALICS)
199
+ comment text
200
+ label
201
+ old id
202
+ id
203
+ Den h¨ar slynan ¨ar galen som
204
+ skulle
205
+ l¨asa
206
+ en
207
+ bok
208
+ av
209
+ en
210
+ kvinna.
211
+ biased
212
+ 239612
213
+ 1212584
214
+ (This b*tch is nuts. Who would
215
+ read a book by a woman.)
216
+ 9 av 10 m¨anniskor njuter av
217
+ mobbning. Jag kommer alltid
218
+ att vara den 10: e
219
+ biased
220
+ none
221
+ 1517517
222
+ (9 out of 10 people enjoy bully-
223
+ ing. I will always be the 10th.)
224
+ ”F¨orfattaren s¨ager att det finns
225
+ ¿ m˚anga, m˚anga fler anled-
226
+ ningar till att jag antar att en
227
+ uppf¨oljare finns i verken, d˚a?”
228
+ unbiased
229
+ 383811
230
+ 110831
231
+ (”The author says that there
232
+ are many, many more reasons I
233
+ am assuming a sequel is in the
234
+ works, then?”)
235
+ Vad kallar du underkl¨ader f¨or
236
+ araber?
237
+ biased
238
+ none
239
+ 1618146
240
+ (What do you call lingerie for
241
+ Arabs? Socks.)
242
+ C. Experiments
243
+ The experiments are conducted on two shared Nvidia DGX-
244
+ 1 clusters running Ubuntu 18.04 and 20.04 with 8 × 32GB
245
+ V100 and 8 x 40GB A100 GPUs, respectively. Average results
246
+ are reported after running each experiment twice. To evaluate
247
+ the benchmark datasets, we use RoBERTa, DeBERTa, and
248
+ Electra bias-detection trained models [3].
249
+ Wandb [17], an experiment tracking tool, is run for 5 counts
250
+ for training Swedish BERT with bayesian optimization to
251
+ suggest the best hyper-parameter combination for the initial
252
+ learning rate (1e-3 - 2e-5) and epochs (6 - 10), since it has
253
+ been observed that hyper-parameters strongly influence per-
254
+ formance [18]. Figure 13 (in the appendix) shows the wandb
255
+ exploration for Swedish BERT on MAB-Swedish in parallel
256
+ coordinates. We use the pretrained base Swedish BERT [12]
257
+ from the HuggingFace hub [19]. Average training time was 15
258
+ hours. Average evaluation time ranges from about 30 minutes
259
+ to over 24 hours for the English benchmark datasets.5
260
+ III. RESULTS AND DISCUSSION
261
+ The macro F1 score on the validation set of MAB-Swedish
262
+ is 0.8688 and standard deviation (s.d.) of 0.0005 (see 13).
263
+ From Table IV we observe that all the datasets have bias,
264
+ though little. The dataset with the least amount of bias is
265
+ Boolq, which is confirmed by all the three models. This
266
+ is despite the dataset having the highest number of unique
267
+ samples. CB has the largest amount of bias and this is also
268
+ confirmed by the three models.
269
+ 5particularly when cpulimit is used, in fairness to other users
270
+
271
+ TABLE IV
272
+ RESULTS OF AVERAGE SCORES.
273
+ bipol level ↓ (s.d.)
274
+ RoBERTa
275
+ unique samples
276
+ corpus
277
+ sentence
278
+ bipol (b)
279
+ Boolq
280
+ 7,929
281
+ 0.0066
282
+ 0.8027
283
+ 0.0053 (0)
284
+ CB
285
+ 250
286
+ 0.08
287
+ 0.8483
288
+ 0.0679 (0)
289
+ WSC
290
+ 279
291
+ 0.0466
292
+ 0.8718
293
+ 0.0406 (0)
294
+ AXg
295
+ 178
296
+ 0.0112
297
+ 1
298
+ 0.0112 (0)
299
+ RTE
300
+ 2,379
301
+ 0.0294
302
+ 0.8518
303
+ 0.0251 (0)
304
+ DeBERTa
305
+ Boolq
306
+ 7,929
307
+ 0.0103
308
+ 0.7212
309
+ 0.0075 (0)
310
+ CB
311
+ 250
312
+ 0.084
313
+ 0.9048
314
+ 0.076 (0)
315
+ WSC
316
+ 279
317
+ 0.0609
318
+ 1
319
+ 0.0609 (0)
320
+ AXg
321
+ 178
322
+ 0.0112
323
+ 1
324
+ 0.0112 (0)
325
+ RTE
326
+ 2,379
327
+ 0.0366
328
+ 0.8655
329
+ 0.0316 (0)
330
+ Electra
331
+ Boolq
332
+ 7,929
333
+ 0.0073
334
+ 0.8089
335
+ 0.0059 (0)
336
+ CB
337
+ 250
338
+ 0.0316
339
+ 0.881
340
+ 0.074 (0)
341
+ WSC
342
+ 279
343
+ 0.0609
344
+ 0.9559
345
+ 0.0582 (0)
346
+ AXg
347
+ 178
348
+ 0.0112
349
+ 1
350
+ 0.0112 (0)
351
+ RTE
352
+ 2,379
353
+ 0.0269
354
+ 0.8593
355
+ 0.0231 (0)
356
+ Explaining bias type
357
+ The type of overall bias (for the gender axis) in many of
358
+ the datasets is explained by the dictionary of lists produced
359
+ by bipol (see Appendix B) and represented in ”top-5 frequent
360
+ terms” bar graphs of Figures 1 to 12. We observe from Figures
361
+ 1, 2, and 3 that Boolq is male-biased. Figures 4, 5, and 6 show
362
+ that CB is also male-biased. This is the case also for RTE, as
363
+ revealed by Figures 7, 8, and 9. On the other hand, we observe
364
+ that the case of WSC is not clear-cut because Figure 10 shows
365
+ only a marginal lead for female bias, Figure 11 shows the
366
+ difference among the top-5 is zero and Figure 12 shows a
367
+ slight overall male bias.
368
+ Fig. 1. Top-5 gender frequent terms in Boolq by RoBERTa.
369
+ IV. RELATED WORK
370
+ Bias can lead to unfair treatment based on factors such as
371
+ gender, age, race, etc [3]. Determining the level of bias in
372
+ NLP datasets along these multiple axes can be a significant
373
+ challenge but there has been considerable effort in identifying
374
+ and analyzing bias along some of these axes [20]–[23]. Studies
375
+ have demonstrated that the biases in language models for the
376
+ intersection of gender and race can be greater than those for
377
+ Fig. 2. Top-5 gender frequent terms in Boolq by DeBERTa.
378
+ Fig. 3. Top-5 gender frequent terms in Boolq by Electra.
379
+ Fig. 4. Top-5 gender frequent terms in CB by Roberta.
380
+ Fig. 5. Top-5 gender frequent terms in CB by DeBERTa.
381
+ Fig. 6. Top-5 gender frequent terms in CB by Electra.
382
+
383
+ 90
384
+ 80
385
+ 80
386
+ 70
387
+ 60
388
+ 49
389
+ 50
390
+ 40
391
+ 30
392
+ 23
393
+ 17
394
+ 20
395
+ 10
396
+ 6
397
+ 8
398
+ 5
399
+ 10
400
+ 3
401
+ 3
402
+ 0
403
+ hel she
404
+ him I her
405
+ male I female
406
+ boy I wife
407
+ jackl love
408
+ Term
409
+ Male
410
+ Female100
411
+ 93
412
+ 89
413
+ 81
414
+ 77
415
+ 80
416
+ Frequency
417
+ 60
418
+ 40
419
+ 20
420
+ 13
421
+ 11
422
+ 10
423
+ 9
424
+ 3
425
+ 4
426
+ 0
427
+ hel she
428
+ him I her
429
+ malel love
430
+ jackI female
431
+ guyl woman
432
+ Term
433
+ Male
434
+ Female80
435
+ 70
436
+ 70
437
+ 60
438
+ 60
439
+ 51
440
+ Frequency
441
+ 50
442
+ 43
443
+ 40
444
+ 30
445
+ 20
446
+ 10
447
+ 7
448
+ 8
449
+ 6
450
+ 10
451
+ 3
452
+ 2
453
+ 0
454
+ hel she
455
+ him I her
456
+ malel love
457
+ jackl female
458
+ guyl woman
459
+ Male
460
+ Female20
461
+ 17
462
+ 15
463
+ Frequency
464
+ 10
465
+ 8
466
+ 7
467
+ 5
468
+ 1
469
+ 0
470
+ 0
471
+ 0
472
+ 0
473
+ 0
474
+ 0
475
+ hel she
476
+ him I her
477
+ boy I girl
478
+ manI woman
479
+ male I female
480
+ Term
481
+ Male
482
+ Female20
483
+ 16
484
+ 15
485
+ 10
486
+ Frequency
487
+ 5
488
+ 4
489
+ 5
490
+ 1
491
+ 1
492
+ 0
493
+ 0
494
+ 0
495
+ 0
496
+ 0
497
+ 0
498
+ hel she
499
+ him I her
500
+ boyI girl
501
+ manI woman
502
+ maleI female
503
+ Term
504
+ IMale
505
+ Female16
506
+ 14
507
+ 14
508
+ 12
509
+ Frequency
510
+ 10
511
+ 8
512
+ 6
513
+ 6
514
+ 4
515
+ 4
516
+ 1
517
+ 2
518
+ 1
519
+ 0
520
+ 0
521
+ 0
522
+ 0
523
+ 0
524
+ 0
525
+ hel she
526
+ him I her
527
+ boyl girl
528
+ manI woman
529
+ malel female
530
+ Term
531
+ Male
532
+ FemaleFig. 7. Top-5 gender frequent terms in RTE by RoBERTa.
533
+ Fig. 8. Top-5 gender frequent terms in RTE by DeBERTa.
534
+ Fig. 9. Top-5 gender frequent terms in RTE by Electra.
535
+ Fig. 10. Top-5 gender frequent terms in WSC by RoBERTa.
536
+ Fig. 11. Top-5 gender frequent terms in WSC by DeBERTa.
537
+ Fig. 12. Top-5 gender frequent terms in WSC by Electra.
538
+ gender and race individually and that addressing bias along
539
+ only one axis can lead to more issues [24], [25]. Our work
540
+ does not limit the number of axes that can be evaluated.
541
+ Addressing bias in the English language is not sufficient.
542
+ [26] proposed a multi-language approach using HurtLex [27].
543
+ In the English language, there are common biases that asso-
544
+ ciate female terms with subjects such as liberal arts and family
545
+ and male terms with subjects such as science [28]. There are
546
+ also more words that sexualize females more than males [22].
547
+ Other languages have their own peculiarities.
548
+ There are various methods for quantifying the extent of
549
+ discrimination or bias that is present in a dataset. One method
550
+ is odds ratio (OR), which compares the chance of a specific
551
+ outcome happening, with a certain exposure, to the likelihood
552
+ of that outcome happening without the exposure [29]. Another
553
+ method is the impact ratio (IR), which calculates the ratio of
554
+ positive outcomes for a protected group to the general group.
555
+ In [20], they compare lexicon method to model classification.
556
+ Our approach combines the strengths of both approaches.
557
+ Other researchers have quantitatively shown the bias present
558
+ in the geometry of word embeddings, which may amplify
559
+ different gender or demographic stereotypes [30]–[32]. To
560
+ address the bias in word embeddings, [33] suggests debiasing
561
+ by removing gender from the embeddings.
562
+ V. CONCLUSION
563
+ We show that all benchmark datasets we evaluated, which
564
+ are available on the SuperGLUE leaderboard, contain bias
565
+ to different degrees. This is the first time these datasets are
566
+ evaluated in such a way that quantifies the amount of bias and
567
+ the type. We believe these evaluations will motivate research
568
+ on how to more effectively mitigate bias along multiple axes in
569
+ datasets. Our public release of the new MAB-Swedish dataset,
570
+ lexica and model will also facilitate future work in multilingual
571
+ bias detection.
572
+ REFERENCES
573
+ [1] N. Mehrabi, F. Morstatter, N. Saxena, K. Lerman, and A. Galstyan,
574
+ “A survey on bias and fairness in machine learning,” ACM Computing
575
+ Surveys (CSUR), vol. 54, no. 6, pp. 1–35, 2021.
576
+ [2] T. P. Adewumi, F. Liwicki, and M. Liwicki, “Conversational systems
577
+ in machine learning from the point of view of the philosophy of
578
+ science—using alime chat and related studies,” Philosophies, vol. 4,
579
+ no. 3, p. 41, 2019.
580
+ [3] L. Alkhaled, T. Adewumi, and S. Sabah Sabry, “Bipol: A novel multi-
581
+ axes bias evaluation metric with explainability for nlp,” Manuscript,
582
+ 2023.
583
+
584
+ 2,5
585
+ 2
586
+ 2
587
+ Frequency
588
+ 1,5
589
+ 1
590
+
591
+ 0,5
592
+ 0
593
+ 0
594
+ 0
595
+ 0
596
+ 0
597
+ 0
598
+ 0
599
+ 0
600
+ 0
601
+ boyI girl
602
+ manI woman
603
+ he I she
604
+ him I her
605
+ malel female
606
+ Term
607
+ ■Male
608
+ Female18
609
+ 16
610
+ 16
611
+ 14
612
+ 11
613
+ 12
614
+ 10
615
+ Frequenc
616
+ 8
617
+ 5
618
+ 6
619
+ 4
620
+ 1
621
+ 2
622
+ 0
623
+ 0
624
+ 0
625
+ 0
626
+ hel her
627
+ him I she
628
+ manI old
629
+ boyI girl
630
+ master woman
631
+ Term
632
+ I Male
633
+ Female12
634
+ 11
635
+ 10
636
+ Frequency
637
+ 8
638
+ 6
639
+ 5
640
+ 4
641
+ 3
642
+ 2
643
+ 1
644
+ 1
645
+ 0
646
+ 0
647
+ 0
648
+ 0
649
+ hel her
650
+ him I she
651
+ manl old
652
+ boyI girl
653
+ master woman
654
+ Term
655
+ ■Male
656
+ Female30
657
+ 25
658
+ 25
659
+ 20
660
+ 16
661
+ Frequency
662
+ 15
663
+ 10
664
+ 5
665
+ 5
666
+ 2
667
+ 2
668
+ 1
669
+ 1
670
+ 1
671
+ 0
672
+ 0
673
+ hel her
674
+ him I she
675
+ boy I girl
676
+ fellowI woman
677
+ male | female
678
+ Term
679
+ I Male
680
+ Female40
681
+ 36
682
+ 30
683
+ Frequency
684
+ 22
685
+ 20
686
+ 13
687
+ 10
688
+ 3
689
+ 3
690
+ 2
691
+ 2
692
+ 1
693
+ 1
694
+ 1
695
+ 0
696
+ hel her
697
+ him I she
698
+ manI woman
699
+ fellow female
700
+ boyI girl
701
+ Term
702
+ Male
703
+ Female30
704
+ 26
705
+ 25
706
+ Frequency.
707
+ 20
708
+ 13
709
+ 13
710
+ 15
711
+ 10
712
+ 6
713
+ 5
714
+ 2
715
+ 2
716
+ 2
717
+ 1
718
+ 1
719
+ 0
720
+ 0
721
+ hel she
722
+ him I her
723
+ boyI girl
724
+ fellowI woman
725
+ manl old
726
+ Term
727
+ Male
728
+ ■Female[4] A. Wang, Y. Pruksachatkun, N. Nangia, A. Singh, J. Michael,
729
+ F.
730
+ Hill,
731
+ O.
732
+ Levy,
733
+ and
734
+ S.
735
+ Bowman,
736
+ “Superglue:
737
+ A
738
+ stickier
739
+ benchmark for general-purpose language understanding systems,” in
740
+ Advances in Neural Information Processing Systems, H. Wallach,
741
+ H.
742
+ Larochelle,
743
+ A.
744
+ Beygelzimer,
745
+ F.
746
+ d'Alch´e-Buc,
747
+ E.
748
+ Fox,
749
+ and
750
+ R.
751
+ Garnett,
752
+ Eds.,
753
+ vol.
754
+ 32.
755
+ Curran
756
+ Associates,
757
+ Inc.,
758
+ 2019. [Online]. Available: https://proceedings.neurips.cc/paper/2019/
759
+ file/4496bf24afe7fab6f046bf4923da8de6-Paper.pdf
760
+ [5] S. Dhar and L. Shamir, “Evaluation of the benchmark datasets for testing
761
+ the efficacy of deep convolutional neural networks,” Visual Informatics,
762
+ vol. 5, no. 3, pp. 92–101, 2021.
763
+ [6] A. Paullada, I. D. Raji, E. M. Bender, E. Denton, and A. Hanna, “Data
764
+ and its (dis) contents: A survey of dataset development and use in
765
+ machine learning research,” Patterns, vol. 2, no. 11, p. 100336, 2021.
766
+ [7] G. Pleiss, M. Raghavan, F. Wu, J. Kleinberg, and K. Q. Weinberger,
767
+ “On fairness and calibration,” in Advances in Neural Information
768
+ Processing Systems, I. Guyon, U. V. Luxburg, S. Bengio, H. Wallach,
769
+ R. Fergus, S. Vishwanathan, and R. Garnett, Eds., vol. 30.
770
+ Curran
771
+ Associates, Inc., 2017. [Online]. Available: https://proceedings.neurips.
772
+ cc/paper/2017/file/b8b9c74ac526fffbeb2d39ab038d1cd7-Paper.pdf
773
+ [8] L. Oneto, M. Doninini, A. Elders, and M. Pontil, “Taking advantage
774
+ of multitask learning for fair classification,” in Proceedings of the 2019
775
+ AAAI/ACM Conference on AI, Ethics, and Society, 2019, pp. 227–237.
776
+ [9] T. Speicher, H. Heidari, N. Grgic-Hlaca, K. P. Gummadi, A. Singla,
777
+ A. Weller, and M. B. Zafar, “A unified approach to quantifying algorith-
778
+ mic unfairness: Measuring individual &group unfairness via inequality
779
+ indices,” in Proceedings of the 24th ACM SIGKDD international con-
780
+ ference on knowledge discovery & data mining, 2018, pp. 2239–2248.
781
+ [10] B. F. Klare, M. J. Burge, J. C. Klontz, R. W. V. Bruegge, and A. K.
782
+ Jain, “Face recognition performance: Role of demographic information,”
783
+ IEEE Transactions on Information Forensics and Security, vol. 7, no. 6,
784
+ pp. 1789–1801, 2012.
785
+ [11] I. D. Raji, T. Gebru, M. Mitchell, J. Buolamwini, J. Lee, and
786
+ E. Denton, “Saving face: Investigating the ethical concerns of facial
787
+ recognition auditing,” in Proceedings of the AAAI/ACM Conference
788
+ on AI, Ethics, and Society, ser. AIES ’20.
789
+ New York, NY, USA:
790
+ Association for Computing Machinery, 2020, p. 145–151. [Online].
791
+ Available: https://doi.org/10.1145/3375627.3375820
792
+ [12] M. Malmsten, L. B¨orjeson, and C. Haffenden, “Playing with words at
793
+ the national library of sweden–making a swedish bert,” arXiv preprint
794
+ arXiv:2007.01658, 2020.
795
+ [13] T. P. Adewumi, F. Liwicki, and M. Liwicki, “Corpora compared: The
796
+ case of the swedish gigaword & wikipedia corpora,” arXiv preprint
797
+ arXiv:2011.03281, 2020.
798
+ [14] ——, “Exploring swedish & english fasttext embeddings for ner with
799
+ the transformer,” arXiv preprint arXiv:2007.16007, 2020.
800
+ [15] J. Tiedemann and S. Thottingal, “OPUS-MT — Building open transla-
801
+ tion services for the World,” in Proceedings of the 22nd Annual Con-
802
+ ferenec of the European Association for Machine Translation (EAMT),
803
+ Lisbon, Portugal, 2020.
804
+ [16] M.
805
+ Sap,
806
+ S.
807
+ Gabriel,
808
+ L.
809
+ Qin,
810
+ D.
811
+ Jurafsky,
812
+ N.
813
+ A.
814
+ Smith,
815
+ and
816
+ Y. Choi, “Social bias frames: Reasoning about social and power
817
+ implications of language,” in Proceedings of the 58th Annual Meeting
818
+ of the Association for Computational Linguistics.
819
+ Online: Association
820
+ for Computational Linguistics, Jul. 2020, pp. 5477–5490. [Online].
821
+ Available: https://www.aclweb.org/anthology/2020.acl-main.486
822
+ [17] L. Biewald, “Experiment tracking with weights and biases,” 2020,
823
+ software
824
+ available
825
+ from
826
+ wandb.com.
827
+ [Online].
828
+ Available:
829
+ https:
830
+ //www.wandb.com/
831
+ [18] T. Adewumi, F. Liwicki, and M. Liwicki, “Word2vec: Optimal
832
+ hyperparameters and their impact on natural language processing
833
+ downstream tasks,” Open Computer Science, vol. 12, no. 1, pp. 134–
834
+ 141, 2022. [Online]. Available: https://doi.org/10.1515/comp-2022-0236
835
+ [19] T. Wolf, L. Debut, V. Sanh, J. Chaumond, C. Delangue, A. Moi,
836
+ P. Cistac, T. Rault, R. Louf, M. Funtowicz, J. Davison, S. Shleifer,
837
+ P. von Platen, C. Ma, Y. Jernite, J. Plu, C. Xu, T. Le Scao,
838
+ S. Gugger, M. Drame, Q. Lhoest, and A. Rush, “Transformers: State-
839
+ of-the-art natural language processing,” in Proceedings of the 2020
840
+ Conference on Empirical Methods in Natural Language Processing:
841
+ System
842
+ Demonstrations.
843
+ Online:
844
+ Association
845
+ for
846
+ Computational
847
+ Linguistics,
848
+ Oct.
849
+ 2020,
850
+ pp.
851
+ 38–45.
852
+ [Online].
853
+ Available:
854
+ https:
855
+ //aclanthology.org/2020.emnlp-demos.6
856
+ [20] J. Cryan, S. Tang, X. Zhang, M. Metzger, H. Zheng, and B. Y.
857
+ Zhao, “Detecting gender stereotypes: Lexicon vs. supervised learning
858
+ methods,” in Proceedings of the 2020 CHI Conference on Human
859
+ Factors in Computing Systems, ser. CHI ’20.
860
+ New York, NY,
861
+ USA: Association for Computing Machinery, 2020, p. 1–11. [Online].
862
+ Available: https://doi.org/10.1145/3313831.3376488
863
+ [21] J. Dhamala, T. Sun, V. Kumar, S. Krishna, Y. Pruksachatkun, K.-W.
864
+ Chang, and R. Gupta, “Bold: Dataset and metrics for measuring
865
+ biases in open-ended language generation,” in ACM FAccT 2021,
866
+ 2021. [Online]. Available: https://www.amazon.science/publications/
867
+ bold-dataset-and-metrics-for-measuring-biases-in-open-ended-language-generation
868
+ [22] J. P. Stanley, “Paradigmatic woman: The prostitute,” Papers in language
869
+ variation, pp. 303–321, 1977.
870
+ [23] A. Chandrabose, B. R. Chakravarthi et al., “An overview of fairness
871
+ in data–illuminating the bias in data pipeline,” in Proceedings of the
872
+ First Workshop on Language Technology for Equality, Diversity and
873
+ Inclusion, 2021, pp. 34–45.
874
+ [24] Y. C. Tan and L. E. Celis, “Assessing social and intersectional biases in
875
+ contextualized word representations,” Advances in Neural Information
876
+ Processing Systems, vol. 32, 2019.
877
+ [25] S. Subramanian, X. Han, T. Baldwin, T. Cohn, and L. Frermann, “Eval-
878
+ uating debiasing techniques for intersectional biases,” arXiv preprint
879
+ arXiv:2109.10441, 2021.
880
+ [26] D. Nozza, F. Bianchi, and D. Hovy, “Honest: Measuring hurtful sentence
881
+ completion in language models,” in The 2021 Conference of the North
882
+ American Chapter of the Association for Computational Linguistics:
883
+ Human Language Technologies.
884
+ Association for Computational Lin-
885
+ guistics, 2021.
886
+ [27] E. Bassignana, V. Basile, and V. Patti, “Hurtlex: A multilingual lexicon
887
+ of words to hurt,” in 5th Italian Conference on Computational Linguis-
888
+ tics, CLiC-it 2018, vol. 2253.
889
+ CEUR-WS, 2018, pp. 1–6.
890
+ [28] B. A. Nosek, M. R. Banaji, and A. G. Greenwald, “Harvesting implicit
891
+ group attitudes and beliefs from a demonstration web site.” Group
892
+ Dynamics: Theory, Research, and Practice, vol. 6, no. 1, p. 101, 2002.
893
+ [29] M. Szumilas, “Explaining odds ratios,” Journal of the Canadian
894
+ academy of child and adolescent psychiatry, vol. 19, no. 3, p. 227,
895
+ 2010.
896
+ [30] T. Bolukbasi, K.-W. Chang, J. Y. Zou, V. Saligrama, and A. T. Kalai,
897
+ “Man is to computer programmer as woman is to homemaker? debiasing
898
+ word embeddings,” Advances in neural information processing systems,
899
+ vol. 29, 2016.
900
+ [31] E. M. Bender, T. Gebru, A. McMillan-Major, and S. Shmitchell, “On
901
+ the dangers of stochastic parrots: Can language models be too big?” in
902
+ Proceedings of the 2021 ACM Conference on Fairness, Accountability,
903
+ and Transparency, 2021, pp. 610–623.
904
+ [32] S. L. Blodgett, S. Barocas, H. Daum´e III, and H. Wallach, “Language
905
+ (technology) is power: A critical survey of” bias” in nlp,” arXiv preprint
906
+ arXiv:2005.14050, 2020.
907
+ [33] B. Schmidt, “Rejecting the gender binary: a vector-space operation,”
908
+ Ben’s Bookworm Blog, 2015.
909
+ [34] C. Clark, K. Lee, M.-W. Chang, T. Kwiatkowski, M. Collins,
910
+ and K. Toutanova, “BoolQ: Exploring the surprising difficulty of
911
+ natural yes/no questions,” in Proceedings of the 2019 Conference of
912
+ the North American Chapter of the Association for Computational
913
+ Linguistics: Human Language Technologies, Volume 1 (Long and Short
914
+ Papers).
915
+ Minneapolis, Minnesota: Association for Computational
916
+ Linguistics, Jun. 2019, pp. 2924–2936. [Online]. Available: https:
917
+ //aclanthology.org/N19-1300
918
+ [35] M.-C. De Marneffe, M. Simons, and J. Tonhauser, “The commit-
919
+ mentbank: Investigating projection in naturally occurring discourse,” in
920
+ proceedings of Sinn und Bedeutung, vol. 23, no. 2, 2019, pp. 107–124.
921
+ [36] H. Levesque, E. Davis, and L. Morgenstern, “The winograd schema
922
+ challenge,” in Thirteenth international conference on the principles of
923
+ knowledge representation and reasoning, 2012.
924
+ [37] R. Rudinger, J. Naradowsky, B. Leonard, and B. Van Durme, “Gender
925
+ bias in coreference resolution,” in Proceedings of the 2018 Conference
926
+ of the North American Chapter of the Association for Computational
927
+ Linguistics: Human Language Technologies.
928
+ New Orleans, Louisiana:
929
+ Association for Computational Linguistics, June 2018.
930
+ APPENDIX
931
+ A. Data
932
+ 1) BoolQ (Boolean Questions): is a question-answering
933
+ (QA) task where each example has a short passage and a
934
+
935
+ yes/no question about the passage [34] . These questions were
936
+ provided anonymously by Google search users and afterwards
937
+ paired with a paragraph from a Wikipedia article that has the
938
+ answer. We evaluated the passage column of the dataset.
939
+ 2) CB:
940
+ [35]: contains short texts in which at least one
941
+ sentence has an embedded clause. The resulting task is framed
942
+ as three-class textual entailment on examples that are drawn
943
+ from the following datasets: Wall Street Journal, fiction from
944
+ the British National Corpus, and Switchboard. We evaluated
945
+ the premise column of the dataset.
946
+ 3) WSC:
947
+ [36]: is a coreference resolution dataset. Exam-
948
+ ples consist of a sentence with a pronoun and a list of noun
949
+ phrases from the sentence. We evaluated the text column of
950
+ the dataset.
951
+ 4) AXg:
952
+ [37]: It is designed to measure gender bias in
953
+ coreference resolution systems. Each example consists of a
954
+ premise sentence having a male or female pronoun and a
955
+ hypothesis giving a possible antecedent of the pronoun. We
956
+ evaluated the premise column of the dataset.
957
+ 5) RTE [4]: : datasets come from a series of annual compe-
958
+ titions on textual entailment. Data from several sources were
959
+ merged and converted to two-class classification: entailment
960
+ and not entailment to obtain this dataset. We evaluated the
961
+ premise column of the dataset.
962
+ B. Experiment
963
+ Dictionary of lists for RoBERTa on Boolq: {’gender’: [’
964
+ she ’: 23, ’ her ’: 17, ’ woman ’: 2, ’ lady ’: 1, ’ female ’:
965
+ 6, ’ girl ’: 1, ’ skirt ’: 0, ’ madam ’: 0, ’ gentlewoman ’: 0,
966
+ ’ madame ’: 0, ’ dame ’: 0, ’ gal ’: 0, ’ maiden ’: 0, ’ maid
967
+ ’: 0, ’ damsel ’: 0, ’ senora ’: 0, ’ lass ’: 0, ’ beauty ’: 0, ’
968
+ ingenue ’: 0, ’ belle ’: 0, ’ doll ’: 0, ’ se˜nora ’: 0, ’ senorita
969
+ ’: 0, ’ lassie ’: 0, ’ ing´enue ’: 0, ’ miss ’: 0, ’ mademoiselle
970
+ ’: 0, ’ se˜norita ’: 0, ’ babe ’: 0, ’ girlfriend ’: 0, ’ lover ’: 0, ’
971
+ mistress ’: 0, ’ ladylove ’: 0, ’ inamorata ’: 0, ’ gill ’: 0, ’ old
972
+ ’: 2, ’ beloved ’: 0, ’ dear ’: 0, ’ sweetheart ’: 0, ’ sweet ’: 0,
973
+ ’ flame ’: 2, ’ love ’: 5, ’ valentine ’: 0, ’ favorite ’: 1, ’ moll
974
+ ’: 0, ’ darling ’: 0, ’ honey ’: 0, ’ significant ’: 0, ’ wife ’: 3,
975
+ ’ wifey ’: 0, ’ missus ’: 0, ’ helpmate ’: 0, ’ helpmeet ’: 0, ’
976
+ spouse ’: 0, ’ bride ’: 1, ’ partner ’: 0, ’ missis ’: 0, ’ widow
977
+ ’: 0, ’ housewife ’: 0, ’ mrs ’: 0, ’ matron ’: 0, ’ soul ’: 3, ’
978
+ mate ’: 1, ’ housekeeper ’: 0, ’ dowager ’: 0, ’ companion ’: 0,
979
+ ’ homemaker ’: 0, ’ consort ’: 0, ’ better half ’: 0, ’ hausfrau
980
+ ’: 0, ’ stay-at-home ’: 0, ’ he ’: 80, ’ him ’: 49, ’ boy ’: 3,
981
+ ’ man ’: 1, ’ male ’: 10, ’ guy ’: 1, ’ masculine ’: 0, ’ virile
982
+ ’: 0, ’ manly ’: 0, ’ man-sized ’: 0, ’ hypermasculine ’: 0, ’
983
+ macho ’: 0, ’ mannish ’: 0, ’ manlike ’: 0, ’ man-size ’: 0, ’
984
+ hairy-chested ’: 0, ’ butch ’: 0, ’ ultramasculine ’: 0, ’ boyish
985
+ ’: 0, ’ tomboyish ’: 0, ’ hoydenish ’: 0, ’ amazonian ’: 0, ’
986
+ gentleman ’: 0, ’ dude ’: 0, ’ fellow ’: 0, ’ cat ’: 2, ’ gent ’:
987
+ 0, ’ fella ’: 0, ’ lad ’: 0, ’ bloke ’: 0, ’ bastard ’: 0, ’ joe ’: 0,
988
+ ’ chap ’: 0, ’ chappie ’: 0, ’ hombre ’: 0, ’ galoot ’: 0, ’ buck
989
+ ’: 0, ’ joker ’: 3, ’ mister ’: 0, ’ jack ’: 8, ’ sir ’: 0, ’ master
990
+ ’: 1, ’ buddy ’: 0, ’ buster ’: 0], ’racial’:... }
991
+
992
+ Fig. 13. WandB parallel coordinates for Swedish BERT training on MAB-Swedish.
993
+
994
+ learning_rate
995
+ f1
996
+ num_train_epochs
997
+ 0.00090
998
+ 0°6
999
+ 0.86930
1000
+ 8.8
1001
+ 0.86920
1002
+ 0.00080
1003
+ 8.6
1004
+ 0.86910
1005
+ 8.4 -
1006
+ 0.00070
1007
+ 0.86900
1008
+ 8.2
1009
+ 0.86890
1010
+ 0.00060
1011
+ 8.0-
1012
+ 0.86880
1013
+ 7.8
1014
+ 0.00050
1015
+ Q.86870
1016
+ 7.6
1017
+ 7.4
1018
+ 0.86860
1019
+ 0.00040
1020
+ 7.2
1021
+ 0.86850
1022
+ 0.00030
1023
+ 7.0
1024
+ 0.86840
1025
+ 6.8
1026
+ 0.86830
1027
+ 0.00020
1028
+ 6.6
1029
+ 0.86820
1030
+ 6.4
1031
+ 0.00010
1032
+ 0.86810
1033
+ 6.2
1034
+ 0.00000
1035
+ 6.0
1036
+ 0.86800
19FLT4oBgHgl3EQfqS-c/content/tmp_files/load_file.txt ADDED
The diff for this file is too large to render. See raw diff
 
1tE1T4oBgHgl3EQflQSM/vector_store/index.faiss ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:045c7fe86272ff156bfa76cd35bb5a0347bb34b8ef96231ece83d0e72d37c617
3
+ size 7471149
3NAzT4oBgHgl3EQfuf1J/content/tmp_files/2301.01691v1.pdf.txt ADDED
@@ -0,0 +1,1040 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ arXiv:2301.01691v1 [physics.plasm-ph] 4 Jan 2023
2
+ Special behavior of alkali beam emission spectroscopy in low-ion-temperature plasma
3
+ P. Bal´azs1,2, O. Asztalos1,2, G. Anda2, M. Vecsei2, S. Zoletnik2, S. T. A. Kumar3, G. I. Pokol1,2
4
+ 1Institute of Nuclear Techniques, Budapest University of Technology and Economics, Budapest, Hungary
5
+ 2Centre for Energy Research, Budapest, Hungary and
6
+ 3Department of Electrical and Computer Engineering, HSX Plasma Laboratory,
7
+ University of Wisconsin-Madison, Madison, WI, United States of America
8
+ Beam emission spectroscopy (BES) is a powerful plasma diagnostic method especially suited for
9
+ the measurement of plasma density and its fluctuations. Designing a BES system for an experimental
10
+ fusion device is, however, not trivial, and the process can be greatly aided by computer simulations
11
+ of how a proposed setup would work in the given environment. This paper presents such analysis
12
+ utilizing the RENATE-OD synthetic diagnostic code for a proposed alkali BES system on the HSX
13
+ stellarator. HSX is a device featuring an unusual operating regime in the world of fusion devices
14
+ due to the low ion temperature and low plasma density. It was found that BES shows unusual
15
+ tendencies in these conditions. The relation between beam energy and plasma penetration in low-
16
+ ion-temperature plasma, together with unique emission features facilitated by low-density plasma,
17
+ and the underlying reasons behind these features are explored in this paper.
18
+ I.
19
+ INTRODUCTION
20
+ In the current development stage of fusion technology,
21
+ plasma diagnostic tools are still much needed to sup-
22
+ port the validation of various theories and verification
23
+ of engineering solutions.
24
+ Active diagnostic techniques,
25
+ when some kind of probing of the plasma is carried out,
26
+ are especially attractive due to their localized measure-
27
+ ments.
28
+ Such a system is beam emission spectroscopy
29
+ (BES), used in several experimental devices, including
30
+ JET [1], ASDEX Upgrade [2], EAST [3], DIII-D [4],
31
+ and even small devices like COMPASS [5]. This tech-
32
+ nique probes the plasma with a neutral atomic beam,
33
+ resulting in the release of light due to interactions with
34
+ the energetic plasma particles. The wavelength of this
35
+ light is characteristic to the beam material, which can be
36
+ one of the hydrogen isotopes in larger beams, or alkali
37
+ metals (lithium, sodium) in the small diagnostic beams.
38
+ The intensity of the emitted light is highly dependent on
39
+ the plasma density, which combined with the ability of
40
+ continuous operation makes the technique ideal for spa-
41
+ tially and temporally resolved density fluctuation mea-
42
+ surements. This is especially true for alkali diagnostic
43
+ beams, with the added benefit of the emission spectrum
44
+ being well distinguishable from the background. The lim-
45
+ itation of this type of BES is the generally short, few cen-
46
+ timeters long penetration into the plasma, but the region
47
+ spanned by this limitation is still interesting in terms of
48
+ transport and magnetohydrodynamic phenomena.
49
+ The construction of a BES system requires careful de-
50
+ sign due to geometric restrictions and the desire to max-
51
+ imize the collectable photon flux [6]. As an aid for this
52
+ problem, one can utilize BES simulation codes designed
53
+ to produce synthetic measurements under the specific
54
+ plasma conditions of the device in question. Based on
55
+ the data of such simulations it is possible to analyze
56
+ the expected performance of the diagnostic system, help-
57
+ ing the engineers to balance between design trade-offs.
58
+ RENATE-OD [7] (Rate Equations for Neutral Alkali-
59
+ beam TEchnique - Open Development) is an open-source
60
+ Python package developed for this purpose. This code
61
+ solves rate equations to calculate the population of each
62
+ atomic level considered in the calculations, from which
63
+ the emissivity of the beam is acquired through the spon-
64
+ taneous transition rate for the observed spectral line.
65
+ With the ability to accurately predict the performance
66
+ of a BES system under design, it is possible to dynami-
67
+ cally test various injection and observation configurations
68
+ for optimal operation.
69
+ RENATE-OD and its precursor, RENATE [8], has al-
70
+ ready been utilized in multiple projects regarding BES
71
+ systems. The code’s capabilities have been validated with
72
+ KSTAR measurements [9, 10], it was the main tool for
73
+ a feasibility study of a BES system for JT60-SA [11],
74
+ and aided the design of lithium beam diagnostics on
75
+ EAST [12]. Recently, we performed a feasibility study for
76
+ the HSX (Helically Symmetric eXperiment) stellarator.
77
+ This device is operated by the Electrical and Computer
78
+ Engineering department of the University of Wisconsin-
79
+ Madison, with the aim of investigating transport, tur-
80
+ bulence, and confinement in a quasi-helically symmetric
81
+ magnetic field [13]. It is a small device with average ma-
82
+ jor and minor radii of 1.2 m and 0.15 m, respectively. The
83
+ magnetic field is produced by copper coils, allowing dis-
84
+ charges up to only 100 ms long, and a maximum on-axis
85
+ magnetic field of 1.25 T. The plasma density achievable in
86
+ the device is on the order of a few times 1018 m−3, which
87
+ is relatively low compared to other fusion-related plasma
88
+ experiments. As a consequence, the electrons heated by
89
+ electron cyclotron resonance are poorly coupled to the
90
+ ions, resulting in an electron and ion population with dis-
91
+ parate temperatures. Throughout this paper, we treated
92
+ the ion temperature as constant at 50 eV throughout the
93
+ machine, while the electron temperature was prescribed
94
+ with a peaked profile reaching a maximum of 2.5 keV
95
+ [14].
96
+ As of now, the device does not have a BES system,
97
+ therefore we performed a feasibility study to explore how
98
+ the technique would perform under such conditions. Part
99
+ of this process was to simulate the evolution of lithium
100
+
101
+ 2
102
+ (Li) and sodium (Na) beams across low-density and low-
103
+ ion-temperature plasma profiles as described before. We
104
+ observed that both the beam density and emissivity can
105
+ behave unusually under these circumstances.
106
+ Notably,
107
+ a beam with low energy could be less attenuated than
108
+ a high-energy beam, and changes in the electron tem-
109
+ perature are more visible in the emission compared to
110
+ measurements in high-density plasma. The reasons be-
111
+ hind these phenomena are explored in this work.
112
+ We
113
+ also note that these plasma conditions are not exclusive
114
+ to HSX, since they can be regularly found in the diver-
115
+ tor region of larger fusion devices. Measurement of these
116
+ regions by BES is an unexplored area, which warrants
117
+ further efforts for investigation.
118
+ The basic methodology of the calculations performed
119
+ by RENATE-OD are presented in Chapter II, then in
120
+ Chapter III the unusual effects found in beam attenua-
121
+ tion and emission are presented together with their ex-
122
+ planation. Finally, in Chapter IV the findings and their
123
+ relevance are summarized.
124
+ II.
125
+ CALCULATIONS
126
+ To simulate the density and emission of an atomic
127
+ beam along its path, RENATE-OD solves the rate equa-
128
+ tions describing the population of the valence electrons
129
+ of the beam atoms on the most populated atomic levels.
130
+ In the case of alkali atoms, the considered levels are the
131
+ l-resolved states reachable by the valence electron up to
132
+ 4.5 eV in the case of lithium, which includes 2s, 2p, 3s,
133
+ 3p, 3d, 4s, 4p, 4d, 4f, and up to 4.1 eV for sodium, in-
134
+ cluding 3s, 3p, 3d, 4s, 4p, 4d, 4f, 5s. The populations
135
+ of the levels evolve due to interactions with the plasma
136
+ components. The simulated light emission is governed by
137
+ collisional excitation to the higher energy levels followed
138
+ by spontaneous emission. The attenuation of the beam
139
+ is contributed to the beam atoms becoming charged, and
140
+ therefore redirected by the perpendicular magnetic field
141
+ component. This can happen through collisional ioniza-
142
+ tion or charge exchange with plasma ions, and we refer
143
+ to the sum of these processes as electron loss. The simu-
144
+ lation does not include interaction between beam atoms
145
+ due to being negligible compared to beam-plasma inter-
146
+ actions. It is also assumed that only the valence electrons
147
+ participate in the relevant processes, and initially, all of
148
+ them are in the ground state.
149
+ The atomic levels can gain or lose electrons through
150
+ multiple channels. For example, if we denote the popu-
151
+ lation density of a particular level with ni, we can write
152
+ its losses due to excitation by electrons in the form of
153
+ �dni
154
+ dt
155
+
156
+ el,exc
157
+ = −nine
158
+
159
+ i<j
160
+ Re,exc
161
+ i→j (T ) ,
162
+ (1)
163
+ where ne is the electron density in the plasma,
164
+ Re,exc
165
+ i→j (T ) is the rate coefficient expressing the probability
166
+ of electron excitation from level i to j, and T is plasma
167
+ temperature. The temperature dependence of the rate
168
+ coefficient originates from the way it is calculated with
169
+ the integral
170
+ R = ⟨σv⟩ =
171
+
172
+ σ(v)vf(v, T )dv ,
173
+ (2)
174
+ where R is a general rate coefficient, σ(v) is the cross-
175
+ section of the reaction, v is the relative velocity of the
176
+ beam atom and plasma particle, and f(v, T ) is the ve-
177
+ locity distribution of the plasma particles.
178
+ The cross-
179
+ sections for the different reactions are based on [15–17]
180
+ for lithium, and on [18] for sodium.
181
+ If we collect all the terms similar to the electron ex-
182
+ citation term in equation (1), namely excitation, de-
183
+ excitation, and electron loss caused by all plasma com-
184
+ ponents, we get an equation for the temporal evolution
185
+ of ni. However, we would like to express the properties
186
+ of the beam spatially along its path (x). Assuming that
187
+ the beam atoms travel with a constant speed (vb) the
188
+ conversion is simply
189
+ dni
190
+ dx = 1
191
+ vb
192
+ dni
193
+ dt .
194
+ (3)
195
+ In this sense, the spatial evolution of a beam can be
196
+ expressed with the reduced rate coefficients, which are
197
+ the regular rate coefficients divided by the beam velocity:
198
+ ¯R = R
199
+ vb
200
+ .
201
+ (4)
202
+ This is the main quantity we study closely when we
203
+ want to explain specific phenomena in beam evolution.
204
+ Its values were precalculated for each type of interaction
205
+ for plasma temperatures in the range of 1 − 105 eV, so
206
+ during the simulation of beams ¯R is looked up according
207
+ to the local plasma temperature for each point of the
208
+ beam.
209
+ III.
210
+ RESULTS
211
+ In order to perform the necessary beam simulations for
212
+ the HSX study, the plasma composition together with the
213
+ density and temperature profiles were required as inputs.
214
+ We assumed a pure hydrogen plasma as a simple test
215
+ case, which also meant equal proton and electron density
216
+ in accordance with charge neutrality. The profiles were
217
+ based on previous publications[14] on the results of the
218
+ experiment. Figure 1 shows the radial electron density
219
+ and temperature profiles, with the minor radius (r) nor-
220
+ malized to the device’s minor radius (a). For ions, the
221
+ same density profile was used, and the ion temperature
222
+ was assumed to be homogeneously 50 eV according to
223
+ [19]. This is different from the conditions found in other
224
+
225
+ 3
226
+ 0.0
227
+ 0.2
228
+ 0.4
229
+ 0.6
230
+ 0.8
231
+ r/a
232
+ 0
233
+ 1
234
+ 2
235
+ 3
236
+ 4
237
+ Electron density [m
238
+ −3
239
+ ]
240
+ 1e18
241
+ a)
242
+ 0.0
243
+ 0.2
244
+ 0.4
245
+ 0.6
246
+ 0.8
247
+ r/a
248
+ 0.0
249
+ 0.5
250
+ 1.0
251
+ 1.5
252
+ 2.0
253
+ 2.5
254
+ Electron temperature [keV]
255
+ b)
256
+ FIG. 1. Electron density (a) and temperature (b) profiles based on [14].
257
+ 0.1
258
+ 0.2
259
+ 0.3
260
+ Distance alo g beam [m]
261
+ 0.5
262
+ 0.6
263
+ 0.7
264
+ 0.8
265
+ 0.9
266
+ 1.0
267
+ Normalized beam de sity
268
+ 1.5
269
+ 2.0
270
+ 2.5
271
+ 3.0
272
+ 3.5
273
+ 4.0
274
+ Electro de sity [m
275
+ −3
276
+ ]
277
+ 1e18
278
+ Li beam de sity
279
+ 10
280
+ 20
281
+ 30
282
+ 40
283
+ 50
284
+ 60
285
+ Beam e ergy [keV]
286
+ a)
287
+ 0.1
288
+ 0.2
289
+ 0.3
290
+ Distance al ng beam [m]
291
+ 0.5
292
+ 0.6
293
+ 0.7
294
+ 0.8
295
+ 0.9
296
+ 1.0
297
+ N rmalized beam density
298
+ 1.5
299
+ 2.0
300
+ 2.5
301
+ 3.0
302
+ 3.5
303
+ 4.0
304
+ Electr n density [m
305
+ −3
306
+ ]
307
+ 1e18
308
+ Na beam density
309
+ 10
310
+ 20
311
+ 30
312
+ 40
313
+ 50
314
+ 60
315
+ Beam energy [keV]
316
+ b)
317
+ FIG. 2. The density of lithium (a) and sodium (b) beams in HSX-like plasma normalized to the initial beam density (solid
318
+ lines). Beam energy is represented by the coloring of the lines. The electron density of the plasma is also shown with the red,
319
+ dashed line. Signs of the inverse relation between beam energy and penetration depth are observable in both cases.
320
+ devices because usually, a higher plasma density ensures
321
+ that the electron and ion population has a similar tem-
322
+ perature.
323
+ A.
324
+ Beam density
325
+ The evolution of lithium and sodium beams calculated
326
+ by RENATE-OD for various energies are plotted in Fig-
327
+ ure 2. Normalized beam density values are used, which
328
+ are acquired through normalization by the initial beam
329
+ density. The beam energies applied are in the range of
330
+ 10-60 keV, which is the usual operating range of alkali
331
+ diagnostic beams.
332
+ The first detail worth noting is the overall attenua-
333
+ tion of the beams across the whole plasma. The beam
334
+ density at the far end of the simulated region is still 50%-
335
+ 62% of the initial density, meaning that a significant por-
336
+ tion of the beam atoms would reach the opposite wall
337
+ from the injection site. Also, in a more usual high-ion-
338
+ temperature plasma, we expect the penetration depth to
339
+ increase with beam energy [20], which is still the situation
340
+ for lithium beams above 25 keV acceleration. However,
341
+ lithium beams under 25 keV and sodium beams in the
342
+ whole energy range exhibit an inverse relation, meaning
343
+ the beams with lower energy can penetrate the plasma
344
+ better.
345
+ In Figure 3 the last normalized beam density values
346
+ of the simulated region are plotted against beam energy,
347
+ showing the remaining portion of the beam atoms after
348
+ traveling through the plasma.
349
+ In the case of lithium,
350
+ the usual tendency of less attenuation with increasing
351
+ beam energy still holds between 25 and 60 keV, but the
352
+ situation reverses under 25 keV. For sodium beams, the
353
+ whole simulated energy range shows the inverse tendency.
354
+ This behavior can be better understood by examin-
355
+
356
+ 4
357
+ 10
358
+ 20
359
+ 30
360
+ 40
361
+ 50
362
+ 60
363
+ Beam energy [keV]
364
+ 0.50
365
+ 0.52
366
+ 0.54
367
+ 0.56
368
+ 0.58
369
+ 0.60
370
+ 0.62
371
+ Normalized beam density
372
+ Last value of the
373
+ normalized beam density for Li
374
+ a)
375
+ 10
376
+ 20
377
+ 30
378
+ 40
379
+ 50
380
+ 60
381
+ Beam energy [keV]
382
+ 0.48
383
+ 0.50
384
+ 0.53
385
+ 0.55
386
+ 0.57
387
+ 0.60
388
+ 0.62
389
+ Normalized beam density
390
+ Last value of the
391
+ normalized beam density for Na
392
+ b)
393
+ FIG. 3. Final values of the normalized beam density at the end of the simulated region. Increasing penetration depth with
394
+ decreasing energy is only present under 25 keV beam energy with lithium (a), while with sodium this is the case for the whole
395
+ energy range (b).
396
+ 10
397
+ 1
398
+ 10
399
+ 3
400
+ 10
401
+ 5
402
+ Proton tem erature [eV]
403
+ 0.2
404
+ 0.4
405
+ 0.6
406
+ 0.8
407
+ 1.0
408
+ 1.2
409
+ 1.4
410
+ Reduced rate coefficient [cm
411
+ 2
412
+ ]
413
+ 1e−14
414
+ Proton im act electron loss from Na(3s)
415
+ 10
416
+ 20
417
+ 30
418
+ 40
419
+ 50
420
+ 60
421
+ Beam energy [keV]
422
+ FIG. 4.
423
+ Reduced rate coefficients calculated with equations
424
+ (2) and (4) for proton impact electron loss from Na(3s) (solid
425
+ lines). The different beam energies are represented by differ-
426
+ ent colors. The dashed lines mark 50 eV and 1 keV proton
427
+ temperature.
428
+ ing the underlying cross-sections and the corresponding
429
+ reduced rate coefficients. In particular, it is enough to
430
+ study the electron loss process from the ground state of
431
+ the beam atoms, since this is the main process behind
432
+ beam attenuation, and processes of the higher levels usu-
433
+ ally follow similar trends as those of the ground level.
434
+ Additionally, the large difference between the tempera-
435
+ ture of the ion and electron population in the plasma
436
+ causes the attenuation to be dominated by proton im-
437
+ pacts, therefore the analysis is concentrated on this pro-
438
+ cess. The following section describes the corresponding
439
+ rate coefficients for sodium beams, but the main effects
440
+ are similar in nature for the lithium beams, too.
441
+ The reduced rate coefficients are shown in Figure 4 as
442
+ continuous functions of ion temperature for the differ-
443
+ ent beam energies. At the ion temperature of the HSX
444
+ plasma, marked with the red and dashed line, beam at-
445
+ tenuation increases with beam energy, which explains the
446
+ results seen in Figure 3. It is also visible that increasing
447
+ the ion temperature, for example up to 1 keV marked by
448
+ the green and dashed line, causes this relation to reverse.
449
+ To understand the connection between the reduced
450
+ rate coefficients and ion temperature, we have to exam-
451
+ ine the quantities found in the integral of equation (2).
452
+ The σ(v)v product and separately the distribution func-
453
+ tion f(v, T ) for the proton impact electron loss rate from
454
+ the 3s level of 10 keV sodium atoms are shown in Fig-
455
+ ure 5/a. For the illustration of how plasma temperature
456
+ changes the rate coefficients, there are two distribution
457
+ functions are plotted, one according to 50 eV and one
458
+ according to 1 keV ion temperature. Note that both of
459
+ these functions are centered on the same relative veloc-
460
+ ity determined by the beam energy. When the plasma
461
+ temperature is low, the distribution function resembles a
462
+ Dirac delta, so the rate coefficient is relatively low. How-
463
+ ever, increasing the temperature widens the distribution
464
+ function, which combined with the convex nature of the
465
+ σ(v)v product increases the rate coefficient.
466
+ On the other hand, the situation is different when we
467
+ perform these calculations for a beam with higher, 60
468
+ keV energy. The same curves are plotted in Figure 5/b
469
+ for this case. It is immediately visible that the distri-
470
+ bution functions are shifted to a higher velocity. This
471
+ has two effects. First, with 50 eV plasma temperature,
472
+ the resulting rate coefficient in Figure 4 is higher for the
473
+ high energy beam, since the Dirac-delta-like distribution
474
+ function selects a higher value from the σ(v)v product.
475
+ However, in this velocity range the curve of this prod-
476
+
477
+ 5
478
+ 0.00
479
+ 0.25
480
+ 0.50
481
+ 0.75
482
+ 1.00
483
+ 1.25
484
+ Velocity [m/s]
485
+ 1e6
486
+ 0
487
+ 1
488
+ 2
489
+ 3
490
+ 4
491
+ 5
492
+ σ(v)v [cm
493
+ 2
494
+ m/s]
495
+ 1e−9
496
+ σ(v)v
497
+ 0.0
498
+ 0.2
499
+ 0.4
500
+ 0.6
501
+ 0.8
502
+ 1.0
503
+ Veloci y dis ribu ion [a.u.]
504
+ f(v) a 10 keV
505
+ 50 eV
506
+ 1000 eV
507
+ a)
508
+ 0.00
509
+ 0.25
510
+ 0.50
511
+ 0.75
512
+ 1.00
513
+ 1.25
514
+ Velocity [m/s]
515
+ 1e6
516
+ 0
517
+ 1
518
+ 2
519
+ 3
520
+ 4
521
+ 5
522
+ σ(v)v [cm
523
+ 2
524
+ m/s]
525
+ 1e−9
526
+ σ(v)v
527
+ 0.0
528
+ 0.2
529
+ 0.4
530
+ 0.6
531
+ 0.8
532
+ 1.0
533
+ Veloci y dis ribu ion [a.u.]
534
+ f(v) a 60 keV
535
+ 50 eV
536
+ 1000 eV
537
+ b)
538
+ FIG. 5. a) Cross-section of electron loss from the 3s level of sodium due to proton impacts, the main channel behind beam
539
+ attenuation, multiplied with the relative velocity as in equation (2). The highlighted section is the velocity range covered by the
540
+ simulated beam energies. The remaining term under the integral in formula (2), the relative velocity distribution function, is
541
+ also plotted for both 50 eV and 1 keV plasma temperature for a 10 keV plasma temperature beam. b) The same curves are also
542
+ plotted for a sodium beam with 60 keV energy.
543
+ uct is concave, so using the wider distribution function
544
+ of 1 keV plasma protons only slightly increases the rate
545
+ coefficient.
546
+ The temperature dependence of proton impact electron
547
+ loss rate coefficients and the low ion temperature explain
548
+ the inverse relation between beam energy and penetra-
549
+ tion depth in the HSX study.
550
+ Usually, neutral beams
551
+ operate in plasma where beam attenuation is driven by
552
+ both a high-temperature ion and high-temperature elec-
553
+ tron population, leading to low-energy beams suffering
554
+ from higher electron loss rates.
555
+ However, in the low-
556
+ ion-temperature and high-electron-temperature plasma
557
+ of HSX, this tendency reverses completely for sodium
558
+ beams, and partially for lithium beams in the examined
559
+ energy region, meaning that low-energy beams experi-
560
+ ence lower electron loss rates.
561
+ B.
562
+ Beam emission
563
+ Understanding the evolution of beam density is an im-
564
+ portant step when evaluating the simulation results, but
565
+ the quantity more directly related to the performance of
566
+ the BES diagnostic system is the emission density of the
567
+ beam. This is acquired by multiplying the population
568
+ density of the upper level of the transition we are in-
569
+ terested in with the spontaneous transition rate to the
570
+ lower level. Since we calculated one-dimensional beam
571
+ evolution, this gives us the linear emission density of the
572
+ simulated beam.
573
+ This quantity is plotted for the previously discussed
574
+ sodium beams in Figure 6. The transition we considered
575
+ is 3p → 3s, as the one observed in existing diagnostic sys-
576
+ tems [21]. As expected, beams with lower energy provide
577
+ higher peak emission densities due to their lower veloc-
578
+ 0.1
579
+ 0.2
580
+ 0.3
581
+ Distance along beam [m]
582
+ 0
583
+ 1
584
+ 2
585
+ 3
586
+ Linea emission density [s
587
+ −1
588
+ m
589
+ −1
590
+ ]
591
+ 1e16
592
+ 0.0
593
+ 0.2
594
+ 0.4
595
+ 0.6
596
+ 0.8
597
+ 1.0
598
+ No malized p ofiles
599
+ Na linea emission density
600
+ T
601
+ e
602
+ n
603
+ e
604
+ 10
605
+ 20
606
+ 30
607
+ 40
608
+ 50
609
+ 60
610
+ Beam ene gy [keV]
611
+ FIG. 6. Linear emission density of sodium beams with differ-
612
+ ent energy (solid lines). The electron temperature and den-
613
+ sity profiles are also plotted with red and black dashed lines,
614
+ respectively. Beams with lower energy emit more light, which
615
+ is expected due to the lower speed of the beam atoms, giving
616
+ more chance for excitation over a given distance. However,
617
+ such a strong reaction to the increase in electron temperature
618
+ is rarely seen, since usually beam evolution is mostly driven
619
+ by plasma density.
620
+ ities through the plasma, providing a higher probability
621
+ for excitation over a given distance.
622
+ The evolution of the emission density is fairly unusual,
623
+ with high emission across the whole plasma, and peaks
624
+ on both sides of the core. The high emission is evidently
625
+ due to the low plasma density, and therefore low beam at-
626
+ tenuation, as seen in the previous section. Regarding the
627
+
628
+ 6
629
+ 10
630
+ 1
631
+ 10
632
+ 3
633
+ 10
634
+ 5
635
+ Electron tempe atu e [eV]
636
+ 0.0
637
+ 0.5
638
+ 1.0
639
+ 1.5
640
+ 2.0
641
+ 2.5
642
+ Reduced ate coefficient [cm
643
+ 2
644
+ ]
645
+ 1e−14
646
+ Elect on impact excitation f om Na(3s) to Na(3p)
647
+ 10
648
+ 20
649
+ 30
650
+ 40
651
+ 50
652
+ 60
653
+ Beam ene gy [keV]
654
+ FIG. 7.
655
+ Reduced rate coefficients in the function of elec-
656
+ tron temperature for electron impact induced excitation from
657
+ Na(3s) to Na(3p), the main reaction channel populating the
658
+ 3p level. In the temperature range of ∼100-2500 eV present
659
+ in the HSX plasma, the rate coefficients are decreasing for all
660
+ beam energies.
661
+ two distinct emission peaks, the explanation lies within
662
+ the temperature dependence of rate coefficients govern-
663
+ ing the population of the 3p level. In particular, the most
664
+ dominant reaction populating this level is electron impact
665
+ excitation from the 3s level. The reduced rate coefficients
666
+ for this process are plotted in Figure 7 for different beam
667
+ energies against electron temperature. In the tempera-
668
+ ture region of the HSX plasma profile (∼100-2500 eV),
669
+ the rate coefficients are steadily decreasing with increas-
670
+ ing temperature, which explains the behavior seen in
671
+ the emission profile. As the beam is traveling through
672
+ the plasma, first the emission is increasing as the higher
673
+ atomic levels get populated due to the increasing plasma
674
+ density. However, as the beam reaches the core plasma,
675
+ there is a rapid increase in electron temperature, lead-
676
+ ing to a significant decrease in the rate at which the 3p
677
+ level gets populated. This is mirrored by a decrease in
678
+ the emission as well.
679
+ After traveling through the core
680
+ plasma, the electron temperature drops again, leading to
681
+ an increase in the beam emission.
682
+ Of course, this effect is always present, but the plasma
683
+ in HSX is unique due to its low density and low beam
684
+ attenuation, allowing the emission to maintain a high
685
+ intensity throughout the plasma, and also due to its ex-
686
+ tremely peaked electron temperature profile, making a
687
+ strong impact on the emission profile.
688
+ IV.
689
+ SUMMARY AND OUTLOOK
690
+ Recently, we completed a feasibility study for the HSX
691
+ stellarator, which has the unique trait among fusion ex-
692
+ periments of studying low-ion-temperature plasma con-
693
+ figurations.
694
+ In the study, we examined the expected
695
+ performance of an alkali beam emission diagnostic sys-
696
+ tem by simulating the beam evolution with our in-house
697
+ code, RENATE-OD. We performed simulations for both
698
+ lithium and sodium beams in the energy range of 10-60
699
+ keV, propagating through a plasma profile acquired from
700
+ earlier experiments.
701
+ The results, namely the relation between plasma pen-
702
+ etration and beam energy, showed unusual effects com-
703
+ pared to other BES diagnostics working in high-ion-
704
+ temperature plasma. Instead of the penetration increas-
705
+ ing with beam energy in the whole energy region, we
706
+ found that low-energy beams achieve better penetration.
707
+ The explanation for this effect is in the underlying elec-
708
+ tron loss cross-sections and the corresponding rate coef-
709
+ ficients.
710
+ The temperature-dependent tendencies of the
711
+ rate coefficients are determined by the curvature of the
712
+ σ(v)v product in the relevant relative velocity region dur-
713
+ ing the integration with the ion distribution function.
714
+ The center of the relevant region is at the velocity of
715
+ beam atoms, and its width is determined by the temper-
716
+ ature of the ion population, so both beam energy and
717
+ ion temperature may have a significant effect on the rate
718
+ coefficients. In case of the HSX-like conditions, this re-
719
+ lation manifests in low-energy beams experiencing lower
720
+ attenuation, than the high-energy beams of the study.
721
+ Apart from beam attenuation, we also examined the
722
+ beam emission density, as the most important quantity
723
+ for the capabilities of the BES diagnostic system. The
724
+ unusual plasma parameters manifested some interesting
725
+ effects in this case as well. First, the low plasma density
726
+ allows the emission density to remain high throughout
727
+ the plasma, unlike in high-density plasma configurations,
728
+ where the emission reaches its peak and decays in a few
729
+ centimeters. This also allows the peaked electron tem-
730
+ perature profile to make its impact on the beam emis-
731
+ sion, since the high temperature in the core lowers the
732
+ rate of the exited states getting populated, resulting in
733
+ decreased emission density in the core.
734
+ Altogether, it is clear that the diagnostics of low-ion-
735
+ temperature and low-density plasma with beam emission
736
+ spectroscopy feature effects unseen in high-density exper-
737
+ iments. While the former conditions are far from those
738
+ of a fusion-supporting plasma, the outer regions and the
739
+ divertor vicinity of future large-scale devices, equipped
740
+ with more exotic divertor configurations like the Super-
741
+ X in MAST-U, are expected to hold plasma resembling
742
+ the HSX conditions [22–24]. These regions form the in-
743
+ terface between the plasma and the chamber, so monitor-
744
+ ing them is important for both scientific and operational
745
+ purposes. If BES is ever used for the diagnostics of these
746
+ areas, the effects described in our study should be con-
747
+ sidered carefully.
748
+
749
+ 7
750
+ ACKNOWLEDGMENTS
751
+ Supported by the KDP-2021 Program of the Ministry
752
+ for Innovation and Technology from the source of the
753
+ National Research, Development and Innovation Fund.
754
+ G.I. Pokol, P. Bal´azs and O. Asztalos acknowledge the
755
+ support of the National Research, Development and In-
756
+ novation Office (NKFIH) Grant FK132134.
757
+ This work has been carried out within the framework
758
+ of the EUROfusion Consortium, funded by the Euro-
759
+ pean Union via the Euratom Research and Training Pro-
760
+ gramme (Grant Agreement No 101052200 - EUROfu-
761
+ sion). Views and opinions expressed are however those of
762
+ the author(s) only and do not necessarily reflect those of
763
+ the European Union or the European Commission. Nei-
764
+ ther the European Union nor the European Commission
765
+ can be held responsible for them.
766
+ [1] M. Brix, D. Dodt, D. Dunai, I. Lupelli, S. Marsen,
767
+ T.
768
+ F.
769
+ Melson,
770
+ B.
771
+ Meszaros,
772
+ P.
773
+ Morgan,
774
+ G.
775
+ Pe-
776
+ travich,
777
+ D. I. Refy,
778
+ C. Silva,
779
+ M. Stamp,
780
+ T. Sz-
781
+ abolics,
782
+ K.-D.
783
+ Zastrow,
784
+ and
785
+ S.
786
+ Zoletnik,
787
+ Recent
788
+ improvements
789
+ of
790
+ the
791
+ JET
792
+ lithium
793
+ beam
794
+ diagnos-
795
+ tic, Review of Scientific Instruments 83, 10D533 (2012),
796
+ https://doi.org/10.1063/1.4739411.
797
+ [2] M. Willensdorfer, G. Birkenmeier, R. Fischer, F. M. Lag-
798
+ gner, E. Wolfrum, G. Veres, F. Aumayr, D. Carralero,
799
+ L. Guimar˜ais, B. Kurzan, and ASDEX Upgrade Team,
800
+ Characterization of the Li-BES at ASDEX Upgrade,
801
+ Plasma Physics and Controlled Fusion 56, 025008 (2014).
802
+ [3] H. J. Wang,
803
+ Y. Yu,
804
+ R. Chen,
805
+ Y. F. Wu,
806
+ B. D.
807
+ Yuan,
808
+ S.
809
+ B.
810
+ Gong,
811
+ Q.
812
+ J.
813
+ Yu,
814
+ B.
815
+ Lyu,
816
+ Y.
817
+ J.
818
+ Shi,
819
+ M. Y. Ye, and B. N. Wan, Development of
820
+ beam
821
+ emission
822
+ spectroscopy
823
+ diagnostic
824
+ on
825
+ EAST,
826
+ Review of Scientific Instruments 88, 083505 (2017),
827
+ https://doi.org/10.1063/1.4997074.
828
+ [4] D.
829
+ M.
830
+ Thomas,
831
+ Development
832
+ of
833
+ lithium
834
+ beam
835
+ emission
836
+ spectroscopy
837
+ as
838
+ an
839
+ edge
840
+ fluctuation
841
+ diagnostic
842
+ for
843
+ DIII-D
844
+ (invited),
845
+ Review of Scientific Instruments 66, 806 (1995),
846
+ https://doi.org/10.1063/1.1146227.
847
+ [5] G. Anda, A. Bencze, M. Berta, D. Dunai, P. Hacek,
848
+ J. Krbec, D. R´efy, T. Krizsan´oczi, S. Bat´o, T. Ilkei,
849
+ I. Kiss,
850
+ G. Veres, and S. Zoletnik, Lithium beam
851
+ diagnostic
852
+ system
853
+ on
854
+ the
855
+ COMPASS
856
+ tokamak,
857
+ Fusion Engineering and Design 108, 1 (2016).
858
+ [6] S. Zoletnik, G. Anda, M. Aradi, O. Asztalos, S. Bat´o,
859
+ A.
860
+ Bencze,
861
+ M.
862
+ Berta,
863
+ G.
864
+ Demeter,
865
+ D.
866
+ Dunai,
867
+ P. Hacek,
868
+ S. Heged˝us,
869
+ G. H. Hu,
870
+ T. Krizsan´oczi,
871
+ M.
872
+ Lampert,
873
+ D.
874
+ Nagy,
875
+ J.
876
+ N´emeth,
877
+ M.
878
+ Otte,
879
+ G. Petravich,
880
+ G. I. Pokol,
881
+ D. R´efy,
882
+ B. T´al, and
883
+ M.
884
+ V´ecsei,
885
+ Advanced neutral
886
+ alkali
887
+ beam
888
+ diagnos-
889
+ tics
890
+ for
891
+ applications
892
+ in
893
+ fusion
894
+ research
895
+ (invited),
896
+ Review of Scientific Instruments 89, 10D107 (2018),
897
+ https://doi.org/10.1063/1.5039309.
898
+ [7] Rate
899
+ Equations
900
+ for
901
+ Neutral
902
+ Alkali-
903
+ beam
904
+ TEchnique
905
+ -
906
+ Open
907
+ Development,
908
+ https://github.com/gergopokol/renate-od.
909
+ [8] I. Pusztai, G. Pokol, D. Dunai, D. R´efy, G. P´or, G. Anda,
910
+ S. Zoletnik, and J. Schweinzer, Deconvolution-based cor-
911
+ rection of alkali beam emission spectroscopy density pro-
912
+ file measurements, Review of Scientific Instruments 80,
913
+ 083502 (2009).
914
+ [9] D.
915
+ Guszejnov,
916
+ G.
917
+ I.
918
+ Pokol,
919
+ I.
920
+ Pusztai,
921
+ D.
922
+ Refy,
923
+ S.
924
+ Zoletnik,
925
+ M.
926
+ Lampert,
927
+ and
928
+ Y.
929
+ U.
930
+ Nam,
931
+ Three-dimensional
932
+ modeling
933
+ of
934
+ beam
935
+ emission
936
+ spectroscopy
937
+ measurements
938
+ in
939
+ fusion
940
+ plasmas,
941
+ Review of Scientific Instruments 83, 113501 (2012),
942
+ https://doi.org/10.1063/1.4764564.
943
+ [10] Y. Nam, S. Zoletnik, M. Lampert, and ´A. Kov´acsik,
944
+ Analysis of edge density fluctuation measured by trial
945
+ KSTAR beam emission spectroscopy system, Review of
946
+ Scientific Instruments 83, 10D531 (2012).
947
+ [11] O. Asztalos, G. Pokol, D. Dunai, G. Boguszlavszkij,
948
+ A. Kovacsik, M. Hellermann, K. Kamiya, T. Suzuki,
949
+ and A. Kojima, Feasibility study on the JT-60SA
950
+ tokamak
951
+ beam
952
+ emission
953
+ spectroscopy
954
+ diagnostics,
955
+ Fusion Engineering and Design 123, 861 (2017),
956
+ pro-
957
+ ceedings of the 29th Symposium on Fusion Technology
958
+ (SOFT-29) Prague, Czech Republic, September 5-9,
959
+ 2016.
960
+ [12] S. Zoletnik, G. H. Hu, B. T´al, D. Dunai, G. Anda,
961
+ O. Asztalos, G. I. Pokol, S. K´alvin, J. N´emeth, and
962
+ T. Krizsan´oczi, Ultrafast two-dimensional lithium beam
963
+ emission spectroscopy diagnostic on the EAST tokamak,
964
+ Review of Scienti��c Instruments 89, 063503 (2018),
965
+ https://doi.org/10.1063/1.5017224.
966
+ [13] F. S. B. Anderson, A. F. Almagri, D. T. Anderson, P. G.
967
+ Matthews, J. N. Talmadge, and J. L. Shohet, The heli-
968
+ cally symmetric experiment,(hsx) goals, design and sta-
969
+ tus, Fusion Technology 27, 273 (1995).
970
+ [14] W. Guttenfelder, J. Lore, D. Anderson, F. Anderson,
971
+ J. Canik, W. Dorland, K. Likin, and J. Talmadge, Ef-
972
+ fect of quasihelical symmetry on trapped-electron mode
973
+ transport in the hsx stellarator, Physical review letters
974
+ 101, 215002 (2008).
975
+ [15] D.
976
+ Wutte,
977
+ R.
978
+ Janev,
979
+ F.
980
+ Aumayr,
981
+ M.
982
+ Schneider,
983
+ J. Schweinzer, J. Smith, and H. Winter, Cross sections for
984
+ collision processes of li atoms interacting with electrons,
985
+ protons, multiply charged ions, and hydrogen molecules,
986
+ Atomic Data and Nuclear Data Tables 65, 155 (1997).
987
+ [16] J. Schweinzer, R. Brandenburg, I. Bray, R. Hoekstra,
988
+ F. Aumayr, R. Janev, and H. Winter, Database for in-
989
+ elastic collisions of lithium atoms with electrons, protons,
990
+ and multiply charged ions, Atomic Data and Nuclear
991
+ Data Tables 72, 239 (1999).
992
+ [17] J. Schweinzer, D. Wutte, and H. Winter, A study of elec-
993
+ tron capture and excitation processes in collisions of mul-
994
+ tiply charged ions with lithium atoms, Journal of Physics
995
+ B: Atomic, Molecular and Optical Physics 27, 137 (1994).
996
+ [18] K. Igenbergs, J. Schweinzer, I. Bray, D. Bridi, and
997
+ F. Aumayr, Database for inelastic collisions of sodium
998
+ atoms with electrons, protons, and multiply charged ions,
999
+ Atomic Data and Nuclear Data Tables 94, 981 (2008).
1000
+ [19] S. Kumar, J. Talmadge, T. Dobbins, F. Anderson,
1001
+ K. Likin, and D. Anderson, Determination of radial elec-
1002
+
1003
+ 8
1004
+ tric field from pfirsch–schl¨uter flows in the hsx stellarator,
1005
+ Nuclear Fusion 57, 036030 (2017).
1006
+ [20] O. Asztalos, Modell-aided design and interpretation of
1007
+ beam emission spectroscopy measurements on fusion de-
1008
+ vices, Ph.D. thesis, Budapest University of Technology
1009
+ and Economics (2022), Chapter 4.1.
1010
+ [21] E. Wolfrum, J. Schweinzer, D. Bridi, K. Igenbergs,
1011
+ J. Kamleitner, F. Aumayr, and A. U. Team, A sodium
1012
+ (na) beam edge diagnostic, Journal of nuclear materials
1013
+ 390, 1110 (2009).
1014
+ [22] E.
1015
+ Havl´ıˇckov´a,
1016
+ W.
1017
+ Fundamenski,
1018
+ M.
1019
+ Wischmeier,
1020
+ G. Fishpool, and D. Coster, Numerical studies of effects
1021
+ associated with the super-x divertor on target parame-
1022
+ ters in mast-u, Journal of Nuclear Materials 438, S545
1023
+ (2013).
1024
+ [23] E.
1025
+ Havl´ıˇckov´a,
1026
+ W.
1027
+ Fundamenski,
1028
+ M.
1029
+ Wischmeier,
1030
+ G. Fishpool, and A. Morris, Investigation of conventional
1031
+ and super-x divertor configurations of mast upgrade us-
1032
+ ing scrape-off layer plasma simulation, Plasma Physics
1033
+ and Controlled Fusion 56, 075008 (2014).
1034
+ [24] E. Havl´ıˇckov´a, J. Harrison, B. Lipschultz, G. Fishpool,
1035
+ A. Kirk, A. Thornton, M. Wischmeier, S. Elmore, and
1036
+ S. Allan, Solps analysis of the mast-u divertor with the
1037
+ effect of heating power and pumping on the access to
1038
+ detachment in the super-x configuration, Plasma Physics
1039
+ and Controlled Fusion 57, 115001 (2015).
1040
+
3NAzT4oBgHgl3EQfuf1J/content/tmp_files/load_file.txt ADDED
The diff for this file is too large to render. See raw diff
 
3NFKT4oBgHgl3EQf8S4-/vector_store/index.faiss ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:ff63691baf239a60cdaf1f8d17bec90a0313b195d0aae2280fb7f1eed2ebeac8
3
+ size 5242925
3tE0T4oBgHgl3EQfeADx/content/tmp_files/load_file.txt ADDED
The diff for this file is too large to render. See raw diff
 
4tE3T4oBgHgl3EQfQQmX/content/2301.04411v1.pdf ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:29c753561310a35ddf84030077fa8a51fad045fadca86f3a631a866c40598c24
3
+ size 1655025
4tE3T4oBgHgl3EQfQQmX/vector_store/index.pkl ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:70fa9ecf16a865ec60bbc6766152c6a5a2fe2ee8efd522b71d20e65030376292
3
+ size 118198
5NE4T4oBgHgl3EQf1Q0a/content/tmp_files/2301.05288v1.pdf.txt ADDED
@@ -0,0 +1,2964 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ arXiv:2301.05288v1 [cs.MA] 12 Jan 2023
2
+ Springer Nature 2021 LATEX template
3
+ An Approach to Stochastic Dynamic Games
4
+ with Asymmetric Information and Hidden
5
+ Actions
6
+ Yi Ouyang1*, Hamidreza Tavafoghi2 and Demosthenis
7
+ Teneketzis3
8
+ 1Preferred Networks America, Inc., Burlingame, CA, USA.
9
+ 2Google, Mountain View, CA, USA.
10
+ 3Department of Electrical Engineering and Computer Science,
11
+ University of Michigan, Ann Arbor, MI, USA.
12
+ *Corresponding author(s). E-mail(s): ouyangyii@gmail.com;
13
+ Contributing authors: hamidreza.tavafoghi@gmail.com;
14
+ teneket@umich.edu;
15
+ Abstract
16
+ We consider in discrete time, a general class of sequential stochastic
17
+ dynamic games with asymmetric information with the following features.
18
+ The underlying system has Markovian dynamics controlled by the agents’
19
+ joint actions. Each agent’s instantaneous utility depends on the current
20
+ system state and the agents’ joint actions. At each time instant each
21
+ agent makes a private noisy observation of the current system state and
22
+ the agents’ actions in the previous time instant. In addition, at each time
23
+ instant all agents have a common noisy observation of the current sys-
24
+ tem state and their actions in the previous time instant. Each agent’s
25
+ actions are part of his private information. The objective is to determine
26
+ Bayesian Nash Equilibrium (BNE) strategy profiles that are based on a
27
+ compressed version of the agents’ information and can be sequentially
28
+ computed; such BNE strategy profiles may not always exist. We present
29
+ an approach/methodology that achieves the above-stated objective,
30
+ along with an instance of a game where BNE strategy profiles with the
31
+ above-mentioned characteristics exist. We show that the methodology
32
+ also works for the case where the agents have no common observations.
33
+ Keywords: Dynamic games, asymmetric information, hidden actions,
34
+ common information, information compression, sequential decomposition
35
+ 1
36
+
37
+ Springer Nature 2021 LATEX template
38
+ 2
39
+ Dynamic Games with Asymmetric Information and Hidden Actions
40
+ 1 Introduction
41
+ We study, in discrete time, a general class of sequential stochastic dynamic
42
+ games with asymmetric information. We consider a setting where the under-
43
+ lying system has Markovian dynamics controlled by the agents’ joint actions.
44
+ Each agent’s instantaneous utility depends on the agents’ joint actions and the
45
+ system state. At each time instant each agent makes a private noisy observa-
46
+ tion that depends on the current system state and the agents’ actions in the
47
+ previous time instant. In addition, at each time instant all agents may have a
48
+ common noisy observation of the system state and their actions in the previous
49
+ time instant. The agents’ actions are hidden, that is, each agent’s actions are
50
+ not directly observable by the other agents. Therefore, at every time instant
51
+ agents have asymmetric and imperfect information about the game’s history.
52
+ Dynamic games with the above features arise in engineering (cybersecurity,
53
+ transportation, energy markets), in economics (industrial organization), and
54
+ in socio-technological applications.
55
+ As pointed out in Tang et al (2022), the key challenges in the study of
56
+ dynamic games with asymmetric information are: (i) The domain of agents’
57
+ strategies increases with time, as the agents acquire information over time.
58
+ Thus, the computational complexity of the agents’ strategies increases with
59
+ time. (ii) Due to signaling1 (Ho, 1980), in many instances an agent’s assess-
60
+ ment of the game’s status at time t, therefore his strategy at time t, depends
61
+ on the strategies of agents who acted before him. Consequently, we cannot
62
+ obtain the standard sequential decomposition (that sequentially determines
63
+ the components of an equilibrium strategy profile) of the kind provided by the
64
+ standard dynamic programming algorithm (where the agent’s optimal strat-
65
+ egy at any time t does not depend on past strategies (Kumar and Varaiya,
66
+ 1986, Chapter 6.5)).
67
+ To address these challenges, we can look for equilibrium strategy profiles
68
+ that are based on a compressed version of the agents’ information and can be
69
+ sequentially computed. However, such equilibrium strategy profiles may not
70
+ exist.
71
+ In this paper we propose an approach, described in detail in Section 3, that
72
+ addresses the above-stated challenges. According to this approach, we first
73
+ compress the agents’ private and common information at each time instant.
74
+ Then, we define strategies based on the compressed information and show that
75
+ Bayesian Nash Equilibria (BNE) based on these strategies can be determined
76
+ sequentially in time moving backwards, if each step of this backwards proce-
77
+ dure has a solution. Finally, we provide an example where a BNE strategy
78
+ profile based on compressed information exists.
79
+ We show that the proposed approach works for the case where the agents
80
+ have no common observations and their actions are hidden.
81
+ 1Signaling in games is more complex than signaling in teams because the agents have diverging
82
+ incentives and their strategies are their own private information.
83
+
84
+ Springer Nature 2021 LATEX template
85
+ Dynamic Games with Asymmetric Information and Hidden Actions
86
+ 3
87
+ 1.1 Related Literature
88
+ Dynamic games with asymmetric information have been extensively investi-
89
+ gated in the literature in the context of repeated discounted games; see Zamir
90
+ (1992); Forges (1992); Aumann et al (1995); Mailath and Samuelson (2006)
91
+ and the references therein. The key feature of these games is the absence of a
92
+ dynamic system. Moreover, the works on repeated games study primarily their
93
+ asymptotic properties when the horizon is infinite and agents are sufficiently
94
+ patient (i.e. the discount factor is close one). In repeated games, agents play
95
+ a stage (static) game repeatedly over time. The main objective of this strand
96
+ of literature is to explore situations where agents can form self-enforcing pun-
97
+ ishment/reward mechanisms so as to create additional equilibria that improve
98
+ upon the payoffs they can get by simply playing an equilibrium of the stage
99
+ game over time. Recent works (see H¨orner et al (2011); Escobar and Toikka
100
+ (2013); Sugaya (2012)) adopt approaches similar to those used in repeated
101
+ games to study infinite horizon dynamic games with asymmetric information
102
+ when there is an underlying dynamic Markovian system. Under certain condi-
103
+ tions on the system dynamics and information structure, the authors of H¨orner
104
+ et al (2011); Escobar and Toikka (2013); Sugaya (2012) characterize a set of
105
+ asymptotic equilibria attained when the agents are sufficiently patient.
106
+ The problem we study in this paper is different from the ones in Zamir
107
+ (1992); Forges (1992); Aumann et al (1995); Mailath and Samuelson (2006);
108
+ H¨orner et al (2011); Escobar and Toikka (2013); Sugaya (2012) in two aspects.
109
+ First, we consider a class of dynamic games where the underlying system
110
+ has general Markovian dynamics and a general information structure, and we
111
+ do not restrict attention to asymptotic behaviors when the horizon is infi-
112
+ nite and the agents are sufficiently patient. Second, we study situations where
113
+ the decision problem that each agent faces, in the absence of strategic inter-
114
+ actions with other agents, is a Partially Observed Markov Decision Process
115
+ (POMDP), which is a complex problem to solve by itself. Therefore, reach-
116
+ ing (and computing) a set of equilibrium strategies, which take into account
117
+ the strategic interactions among the agents, is a very challenging task. As a
118
+ result, it is not very plausible for the agents to seek reaching equilibria that
119
+ are generated by the formation of self-enforcing punishment/reward mecha-
120
+ nisms similar to those used in infinitely repeated games. We believe that our
121
+ results provide new insight into the behavior of strategic agents in complex and
122
+ dynamic environments, and complement the existing results in the repeated
123
+ games literature.
124
+ Stochastic dynamic zero-sum games with asymmetric information have
125
+ been studied in Renault (2006); Cardaliaguet et al (2015); Gensbittel and
126
+ Renault (2015); Li et al (2017); Kartik and Nayyar (2021); Zheng and Casta˜n´on
127
+ (2013); Li and Shamma (2014). The authors of Renault (2006); Cardaliaguet
128
+ et al (2015); Zheng and Casta˜n´on (2013); Li and Shamma (2014) study zero-
129
+ sum games with Markovian dynamics and lack of information on one side
130
+ (i.e. one informed and one uninformed agent). The authors of Gensbittel and
131
+ Renault (2015); Li et al (2017); Kartik and Nayyar (2021) study zero-sum
132
+
133
+ Springer Nature 2021 LATEX template
134
+ 4
135
+ Dynamic Games with Asymmetric Information and Hidden Actions
136
+ games with Markovian dynamics and lack of information on both sides. The
137
+ works of Renault (2006); Cardaliaguet et al (2015); Gensbittel and Renault
138
+ (2015); Li et al (2017); Kartik and Nayyar (2021); Zheng and Casta˜n´on
139
+ (2013); Li and Shamma (2014) consider specific information structures. Specif-
140
+ ically: the actions of both agents are publicly observed; in Renault (2006);
141
+ Cardaliaguet et al (2015); Zheng and Casta˜n´on (2013); Li and Shamma (2014)
142
+ the informed agent observes perfectly the state of the dynamic system, the
143
+ other agent has no direct observation of the system’s state; in Gensbittel
144
+ and Renault (2015); Li et al (2017) each agent observes perfectly part of the
145
+ system’s state and the states observed by the two agents are either indepen-
146
+ dent or conditionally independent (given the observed actions). The authors
147
+ of Kartik and Nayyar (2021) consider a general information structure where
148
+ each agent has some private information and the agents share some infor-
149
+ mation about the dynamic system’s state and their actions. The authors of
150
+ Renault (2006); Cardaliaguet et al (2015); Gensbittel and Renault (2015); Li
151
+ et al (2017); Kartik and Nayyar (2021); Zheng and Casta˜n´on (2013); Li and
152
+ Shamma (2014) derive their results by taking advantage of properties of zero-
153
+ sum games such as the interchangeability of equilibrium strategies and the
154
+ unique value of the game. These properties do not extend to non-zero sum
155
+ games. We study a general class of stochastic dynamic games that include
156
+ zero-sum stochastic dynamic games with asymmetric information as a special
157
+ case. We consider general Markovian dynamics for the underlying system in
158
+ contrast to Renault (2006); Cardaliaguet et al (2015); Gensbittel and Renault
159
+ (2015); Li et al (2017); Zheng and Casta˜n´on (2013); Li and Shamma (2014),
160
+ where the system has the special structure described above. We consider a
161
+ general information structure that allows us to capture scenarios with unob-
162
+ servable actions and imperfect observations that are not captured by Renault
163
+ (2006); Cardaliaguet et al (2015); Gensbittel and Renault (2015); Li et al
164
+ (2017); Zheng and Casta˜n´on (2013); Li and Shamma (2014).
165
+ The problems investigated in Tang et al (2022); Nayyar et al (2014); Gupta
166
+ et al (2014); Ouyang et al (2015, 2017); Vasal and Anastasopoulos (2016);
167
+ Sinha and Anastasopoulos (2016); Gupta et al (2016); Nayyar et al (2013a)
168
+ are the most closely related to our problem. The authors of Nayyar et al
169
+ (2014); Gupta et al (2014, 2016); Nayyar et al (2013a) study a class of dynamic
170
+ games where the agents’ common information based belief (defined in Nayyar
171
+ et al (2014)) is independent of their strategies, that is, there is no signaling
172
+ among them. This property allows them to apply ideas from the common
173
+ information approach developed in Nayyar et al (2011, 2013b), and define an
174
+ equivalent dynamic game with symmetric information among fictitious agents.
175
+ Consequently, they characterize a class of equilibria for dynamic games called
176
+ Common Information based Markov Perfect Equilibria.
177
+ Our results are different from those in Nayyar et al (2014); Gupta et al
178
+ (2014, 2016); Nayyar et al (2013a) in two aspects. First, we consider a general
179
+ class of dynamic games where the agents’ CIB beliefs are strategy-dependent,
180
+ thus, signaling is present. Second, the proposed approach in Nayyar et al
181
+
182
+ Springer Nature 2021 LATEX template
183
+ Dynamic Games with Asymmetric Information and Hidden Actions
184
+ 5
185
+ (2014); Gupta et al (2014, 2016); Nayyar et al (2013a) requires the agents
186
+ to keep track of all of their private information over time. We propose an
187
+ approach to effectively compress the agents’ private information, and conse-
188
+ quently, reduce the number of variables which the agents need to form CIB
189
+ beliefs.
190
+ The authors of Tang et al (2022); Ouyang et al (2015, 2017); Vasal and
191
+ Anastasopoulos (2016); Sinha and Anastasopoulos (2016) study a class of
192
+ dynamic games with asymmetric information where signaling occurs. When the
193
+ horizon in finite, the authors of Ouyang et al (2015, 2017) introduce the notion
194
+ of Common Information Based Perfect Bayesian Equilibrium, and provide a
195
+ sequential decomposition of the game over time. The authors of Vasal and
196
+ Anastasopoulos (2016); Sinha and Anastasopoulos (2016) extend the results of
197
+ Ouyang et al (2015, 2017) to finite horizon Linear-Quadratic-Gaussian (LQG)
198
+ dynamic games and infinite horizon dynamic games, respectively.
199
+ The work of Tang et al (2022) extends the model of Ouyang et al (2017)
200
+ to games among teams of agents. Each agent has his own private informa-
201
+ tion which he shares with the members of his own team with delay d; teams
202
+ also have common information. The authors of Tang et al (2022) consider two
203
+ classes of strategies: sufficient private information based (SPIB) strategies,
204
+ which only compress private information, and sufficient private and common
205
+ information based (SPCIB) strategies, which compress both common and pri-
206
+ vate information. They show that SPIB-strategy-based BNE exist and the set
207
+ of payoff profiles of such equilibria is the same as the set of all BNE. They
208
+ develop a backward inductive sequential procedure, whose solution, if it exists,
209
+ provides a SPCIB BNE, and identify instances which guarantee the existence
210
+ of SPCIB BNE. The class of dynamic games studied in Tang et al (2022);
211
+ Ouyang et al (2015, 2017); Vasal and Anastasopoulos (2016); Sinha and Anas-
212
+ tasopoulos (2016) satisfy the following assumptions: (i) agents’ actions are
213
+ observable (ii) each agent has a perfect observation of his own local states/-
214
+ type (iii) conditioned on the agents’ actions, the evolution of the local states
215
+ are independent. We relax assumptions (i)-(iii) of Tang et al (2022); Ouyang
216
+ et al (2015, 2017); Vasal and Anastasopoulos (2016); Sinha and Anastasopoulos
217
+ (2016), and study a general class of dynamic games with asymmetric infor-
218
+ mation, hidden actions, imperfect observations, and controlled and coupled
219
+ dynamics.
220
+ 1.2 Contribution
221
+ We study/analyze, in discrete time, a general class of sequential stochastic
222
+ dynamic games with asymmetric information, where the underlying system is
223
+ dynamic, the information structure is non-classical, at each time instant the
224
+ agents have private and common information and their actions are hidden
225
+ (each agent’s actions are not directly observable by the other agents). Our key
226
+ contribution is a methodology for the discovery of Bayesian Nash Equilibrium
227
+ (BNE) strategy profiles that are based on the agents’ compressed private and
228
+
229
+ Springer Nature 2021 LATEX template
230
+ 6
231
+ Dynamic Games with Asymmetric Information and Hidden Actions
232
+ common information and can be determined sequentially in time moving back-
233
+ wards, if each step of this backward procedure has a solution. We present an
234
+ example where such a BNE strategy profile exists. We show that our method-
235
+ ology works also for the case where the agents have no common observations
236
+ and their actions are hidden.
237
+ 1.3 Organization
238
+ The rest of the paper is organized as follows: We present the game’s model
239
+ along with the equilibrium concept in Section 2. We state our objective and
240
+ present the methodology that achieves it in Section 3. In Section 4 we first
241
+ introduce compressed versions of the agents’ private and common informa-
242
+ tion that are sufficient for decision making purposes; then we define Sufficient
243
+ Information Based (SIB) strategies that are based on the agents’ compressed
244
+ information. In Section 5 we first introduce Sufficient Information Based
245
+ Bayesian Nash Equilibrium (SIB-BNE); then we present a sequential decom-
246
+ position of the game, that is, a backward inductive procedure that determines
247
+ SIB-BNE if each step of this procedure has a solution. In Section 6 we present
248
+ an example that highlights our solution methodology and where a SIB-BNE
249
+ exists. In Section 7 we show that our solution methodology works for stochas-
250
+ tic dynamic games where the agents have no common observations and each
251
+ agent’s actions are part of his private information. The comparison of the
252
+ definitions of compressed private information as it appears in this paper and
253
+ in Tavafoghi et al (2022), along with some of the technical details related to
254
+ the existence of SIB-BNE for the example of Section 6 are presented in the
255
+ Appendices.
256
+ 2 Model
257
+ We present our model for dynamic decision problems with strategic agents
258
+ (dynamic games) below; this model is an analogue to the model of Tavafoghi
259
+ et al (2022) for dynamic decision problems with non-strategic agents.
260
+ 2.1 System Dynamics
261
+ There are N strategic agents who live in a dynamic Markovian world over
262
+ horizon T := {1, 2, ..., T }, T < ∞. Let Xt ∈ Xt denote the state of the world
263
+ at t ∈ T . At time t, each agent, indexed by i ∈ N := {1, 2, ..., N}, chooses an
264
+ action ai
265
+ t∈Ai
266
+ t, where Ai
267
+ t denotes the set of available actions to him at t. Given
268
+ the collective action profile At := (A1
269
+ t , ..., AN
270
+ t ), the state of the world evolves
271
+ according to the following stochastic dynamic equation,
272
+ Xt+1 = ft(Xt, At, W x
273
+ t ),
274
+ (1)
275
+ where W x
276
+ 1:T −1 is a sequence of independent random variables. The initial state
277
+ X1 is a random variable that has a probability distribution µ0 ∈ ∆(X1).
278
+
279
+ Springer Nature 2021 LATEX template
280
+ Dynamic Games with Asymmetric Information and Hidden Actions
281
+ 7
282
+ At every time t ∈ T , before taking an action, agent i receives a noisy private
283
+ observation Y i
284
+ t ∈ Yi
285
+ t of the current state of the world Xt and the action profile
286
+ At−1, given by
287
+ Y i
288
+ t = Oi
289
+ t(Xt, At−1, W i
290
+ t ),
291
+ (2)
292
+ where W i
293
+ 1:T , i ∈ N, are sequences of independent random variables. Moreover,
294
+ at every t ∈ T , all agents receive a common observation Zt ∈ Zt of the current
295
+ state of the world Xt and the action profile At−1, given by
296
+ Zt = Oc
297
+ t(Xt, At−1, W c
298
+ t ),
299
+ (3)
300
+ where W c
301
+ 1:T , is a sequence of independent random variables. We assume that
302
+ the random variables X1, W x
303
+ 1:T −1, W c
304
+ 1:T , and W i
305
+ 1:T , i ∈ N are mutually
306
+ independent.
307
+ To avoid measure-theoretic technical difficulties and for clarity and conve-
308
+ nience of exposition, we assume that all the random variables take values in
309
+ finite sets.
310
+ Assumption 1. (finite game) The sets N, Xt, Zt, Yi
311
+ t, Ai
312
+ t, i ∈ N, are finite.
313
+ 2.2
314
+ Information Structure
315
+ Let Ht denote the aggregate information of all agents at time t. Assuming that
316
+ agents have perfect recall, we have Ht = {Z1:t, Y 1:N
317
+ 1:t , A1:N
318
+ 1:t−1}, i.e. Ht denotes
319
+ the set of all agents’ past and present observations and all agents’ past actions.
320
+ The set of all possible realizations of the agents’ aggregate information is given
321
+ by Ht := �
322
+ τ≤t Zτ × �
323
+ i∈N
324
+
325
+ τ≤t Yi
326
+ τ × �
327
+ i∈N
328
+
329
+ τ<t Ai
330
+ τ.
331
+ At time t∈T , the aggregate information Ht is not fully known to all agents.
332
+ Let Ct := {Z1:t} ∈ Ct denote the agents’ common information about Ht and
333
+ P i
334
+ t := {Y i
335
+ 1:t, Ai
336
+ 1:t−1}\Ct ∈ Pi
337
+ t denote agent i’s private information about Ht,
338
+ where Pi
339
+ t and Ct denote the set of all possible realizations of agent i’s private
340
+ and common information at time t, respectively. We assume that observations
341
+ Y i
342
+ τ , τ ∈ {1, 2..., t}, and actions Ai
343
+ τ, τ ∈ {1, 2..., t−1}, are known to agent i but
344
+ are not necessarily fully known to all other agents, denoted by −i, at t ∈ T .
345
+ Therefore, we have P i
346
+ t ⊆ {Y i
347
+ 1:t, Ai
348
+ 1:t−1} for all i ∈ N, and Ht =
349
+ ��
350
+ i∈N P i
351
+ t
352
+
353
+ ∪Ct
354
+ for all t ∈ T . As such,
355
+
356
+ Ct, P i
357
+ t , i ∈ N
358
+
359
+ form a partition of Ht at every time
360
+ t ∈ T . In Section 2.5, we discuss several instances of information structures
361
+ that can be captured as special cases of our model.
362
+ 2.3 Strategies and Utilities:
363
+ Let Hi
364
+ t := {Ct, P i
365
+ t } ∈ Hi
366
+ t denote the information available to agent i at t,
367
+ where Hi
368
+ t denote the set of all possible realizations of agent i’s information at
369
+ t. Agent i’s behavioral strategy at t, denoted by gi
370
+ t, is defined by
371
+ gi
372
+ t : Hi
373
+ t → ∆(Ai
374
+ t)
375
+ (4)
376
+
377
+ Springer Nature 2021 LATEX template
378
+ 8
379
+ Dynamic Games with Asymmetric Information and Hidden Actions
380
+ where ∆(Ai
381
+ t) is the set of Probability Mass Functions (PMFs) on Ai
382
+ t. We
383
+ denote by
384
+ gi := (gi
385
+ 1, gi
386
+ 2, . . . , gi
387
+ T )
388
+ (5)
389
+ a strategy of agent i; gi ∈ Gi, where Gi is the set of admissible strategies
390
+ described by (4)-(5). We denote a strategy profile g by
391
+ g := (g1, g2, . . . , gN)
392
+ (6)
393
+ g ∈ G, where G is the set of admissible strategy profiles described by (4)-(6).
394
+ We denote by
395
+ g−i := (g1, . . . , gi−1, gi+1, . . . , gN)
396
+ (7)
397
+ Agent i’s instantaneous utility at t depends on the system state Xt and the
398
+ collective action profile At, and is given by ui
399
+ t(Xt,At). Agent i’s total utility
400
+ over horizon T , is given by,
401
+ U i(X1:T , A1:T ) =
402
+
403
+ t∈T
404
+ ui
405
+ t(Xt, At).
406
+ (8)
407
+ 2.4 Equilibrium Concept:
408
+ We consider Bayesian Nash Equilibrium (BNE) as the solution concept (Fuden-
409
+ berg and Tirole, 1991). A strategy profile g∗ = (g∗1, g∗2, . . . , g∗N) is a BNE if
410
+ for all i ∈ N
411
+ Eg∗{U i(X1:T , A1:T )} ≥ Eg∗−i,ˆgi{U i(X1:T , A1:T )}, ∀ˆgi ∈ Gi.
412
+ (9)
413
+ 2.5 Special Cases
414
+ We discuss several instances of dynamic games with asymmetric information
415
+ that are special cases of the general model described above.
416
+ 1) Nested information structure: Consider a two-player game with one
417
+ informed player and one uninformed player and general Markovian dynamics.
418
+ At every time t∈T , the informed player makes a private perfect observation of
419
+ the state Xt, i.e. Y 1
420
+ t =Xt. The uninformed player does not have any observa-
421
+ tion of the state Xt. Both the informed and uninformed players observe each
422
+ others’ actions, i.e. Zt={At−1}. Therefore, we have P 1
423
+ t = {X1:t}, P 2
424
+ t = ∅, and
425
+ Ct={A1
426
+ 1:t−1,A2
427
+ 1:t−1} for all t∈T . The above nested information structure cor-
428
+ responds to dynamic games considered in Renault (2006); Cardaliaguet et al
429
+ (2015); Renault (2012); Li and Shamma (2014, 2017); Zheng and Casta˜n´on
430
+ (2013), where in Renault (2012); Li and Shamma (2017) the state Xt is static.
431
+ 2) Delayed sharing information structure: Consider a N-player game with
432
+ observable actions where agents observe each others’ observations with d-step
433
+
434
+ Springer Nature 2021 LATEX template
435
+ Dynamic Games with Asymmetric Information and Hidden Actions
436
+ 9
437
+ delay. That is, P i
438
+ t = {Y i
439
+ t−d+1:t} and Ct = {Y1:t−d, A1:t−1}. We note that in
440
+ our model we assume that the agents’ common observation Zt at t is only a
441
+ function of Xt and and At−1. Therefore, to describe the game with delayed
442
+ sharing information structure within the context of our model we need to
443
+ augment our state space to include the agents’ last d observations as part of
444
+ the augmented state. Define ˜Xt := {Xt, M 1
445
+ t , M 2
446
+ t , ..., M d
447
+ t } as the augmented
448
+ system state where M i
449
+ t := {At−i, Yt−i} ∈ At−i×Yt−i, i ∈ N; that is, M i
450
+ t serves
451
+ as a temporal memory for the agents’ observation Yt−i at t − i. Then, we have
452
+ ˜Xt+1 = {Xt+1, M 1
453
+ t+1, M 2
454
+ t+1, ..., M d
455
+ t+1} = {ft(Xt, At, W x
456
+ t ), (Yt), M 1
457
+ t , ..., M d−1
458
+ t
459
+ }
460
+ and Zt = {M d
461
+ t , At−1} = {Yt−d, At−1}.
462
+ The above environment captures a connection between the symmetric
463
+ information structure and asymmetric information structure. The informa-
464
+ tion asymmetry among the agents increases as d increases. The above delayed
465
+ sharing information structure corresponds to the dynamic game considered in
466
+ Tavafoghi et al (2016).
467
+ 3) Perfectly controlled dynamics with hidden actions: Consider a N-player
468
+ game where the state Xt:=(X1
469
+ t,X2
470
+ t,...,XN
471
+ t ) has N components. Agent i, i∈N,
472
+ perfectly controls Xi
473
+ t, i.e. Xi
474
+ t+1 = Ai
475
+ t. Agent i’s actions Ai
476
+ t, t ∈ T , are not
477
+ observable by all other agents −i. Every agent i, i∈N, makes a noisy private
478
+ observation Y t
479
+ i (Xt, W i
480
+ t ) of the system state at t∈T . Therefore, we have P i
481
+ t :=
482
+ {A1:t, Y i
483
+ 1:t}, Ct=∅.
484
+ 3 Objective and Methodology
485
+ 3.1 Objective
486
+ Our objective is twofold: (i) To determine BNE strategy profiles that are based
487
+ on compressed versions of the agents’ private and common information. (ii)
488
+ To compute the above-mentioned strategy profiles by a sequential decomposi-
489
+ tion of the game, that is, by a backward inductive sequential procedure that
490
+ identifies an equilibrium strategy profile when every step of the procedure has
491
+ a solution.
492
+ 3.2 Methodology
493
+ We present a methodology that achieves the above-state objective and
494
+ proceeds as follows:
495
+ • Step 1. We determine a mutually consistent compression of the agents’
496
+ private information that is sufficient for decision-making purposes (such a
497
+ mutually consistent compression may not be unique). Based on this com-
498
+ pression we introduce the Sufficient Private Information Based (SPIB)
499
+ belief system.
500
+ • Step 2. Based on the result of Step 1, we determine a compression of the
501
+ agents’ common information that is sufficient for decision-making pur-
502
+ poses by defining the Common Information Based (CIB) belief system.
503
+ The CIB belief system ensures that at each time instant each agent’s CIB
504
+
505
+ Springer Nature 2021 LATEX template
506
+ 10
507
+ Dynamic Games with Asymmetric Information and Hidden Actions
508
+ belief is consistent with his SPIB belief even when the agent deviates from
509
+ his equilibrium strategy and plays an arbitrary strategy. Such a consis-
510
+ tency implies that each agent forms his own CIB belief system, and each
511
+ agent’s CIB belief system is common knowledge among all agents.
512
+ • Step 3. Based on the compression of the agents’ private and common
513
+ information we introduce Sufficient Information Based (SIB) strategies
514
+ for each agent (i.e., strategies that depend at each time on the agent’s suf-
515
+ ficient private information and the CIB belief system) and SIB BNE. We
516
+ show that SIB strategies satisfy a key closedness of best response prop-
517
+ erty. Based on this property we provide a sequential decomposition of the
518
+ game, that is, a backward inductive sequential procedure that determines
519
+ a SIB BNE if each step of the procedure has a solution.
520
+ • Step 4. We provide an example of a stochastic dynamic game with asym-
521
+ metric information and hidden/unobservable actions where a SIB BNE
522
+ exists.
523
+ 4 Compression of Private and Common
524
+ Information
525
+ In Section 4.1 we characterize/determine mutually consistent compressions
526
+ of all agents’ private information that are sufficient for decision-making pur-
527
+ poses. In Section 4.2 we introduce the common information based belief, a
528
+ compressed version of the agents’ common information, that is sufficient for
529
+ decision making purposes.
530
+ 4.1 Sufficient private information (Step 1)
531
+ We present/consider a compression of the agents’ private information that is
532
+ done in a mutually consistent manner so that the compressed information is
533
+ sufficient for decision making purposes.
534
+ Definition 1 (Sufficient private information). We say that Si
535
+ t, i = 1, . . . , N,
536
+ is sufficient private information for the agents if
537
+ (i) Si
538
+ t is a function of Hi
539
+ t such that Si
540
+ t = ζi
541
+ t(Hi
542
+ t) for some commonly known
543
+ functions ζi
544
+ t, i = 1, 2, . . . , N.
545
+ (ii) Si
546
+ t can be sequentially updated as Si
547
+ t = φi
548
+ t(Si
549
+ t−1, Y i
550
+ t , Zt, Ai
551
+ t−1) using some
552
+ commonly known functions φi
553
+ t, i = 1, 2, . . . , N.
554
+ (iii) For any realization xt, p−i
555
+ t , pi
556
+ t, ct, and the corresponding s−i
557
+ t
558
+ = ζ−i
559
+ t (p−i
560
+ t , ct)
561
+ and si
562
+ t = ζi
563
+ t(pi
564
+ t, ct), and any strategy profile g, where gi
565
+ t : Si
566
+ t × Ct →
567
+ ∆(Ai
568
+ t), ∀i, ∀t, such that Pg(pi
569
+ t, ct) > 0,
570
+ Pg(xt, s−i
571
+ t
572
+ | si
573
+ t, ct) = Pg(xt, s−i
574
+ t
575
+ | pi
576
+ t, ct)
577
+ (10)
578
+ Remark 1. A similar definition of sufficient private information for dynamic
579
+ teams appears in (Tavafoghi et al, 2022, Definition 2). This definition is slightly
580
+
581
+ Springer Nature 2021 LATEX template
582
+ Dynamic Games with Asymmetric Information and Hidden Actions
583
+ 11
584
+ different from Definition 1 above because the objectives in Tavafoghi et al
585
+ (2022) and this paper are different. In Appendix .1 we show that sufficient
586
+ private information satisfying Definition 1 may violate condition (ii) of Defi-
587
+ nition 2 in Tavafoghi et al (2022). In Tavafoghi et al (2022) the compression
588
+ of private (and common) information must entail no loss in performance, that
589
+ is, we must be able to determine globally optimal team strategy profiles that are
590
+ based on compressed private and common information. In this paper the goal
591
+ is to determine BNE strategy profiles that are based on compressed informa-
592
+ tion and be sequentially computed (if such BNE strategy profiles exist). We are
593
+ not concerned about the equilibria we may lose when we compress information;
594
+ therefore, we don’t need condition (ii) of Definition 2 in Tavafoghi et al (2022).
595
+ Definition 1 characterizes a set of compressions for agents’ private infor-
596
+ mation. In the following, we show the set of sufficient private information Si
597
+ t,
598
+ i ∈ N, t ∈ N, is rich enough to form belief systems on information sets of
599
+ realizations with positive or zero probability. Let ˜gi denote the uniform strat-
600
+ egy that assigns equal probability to every action of agent i ∈ N. Below we
601
+ show that the policy-independence property of belief (Tavafoghi et al, 2022,
602
+ Theorem 1) for agent i is still true when the private information pi
603
+ t is replaced
604
+ with the sufficient private information si
605
+ t. That is, P˜gi,g−i(xt, x−i
606
+ t
607
+ | si
608
+ t, ct) con-
609
+ structed by (˜gi, g−i) captures agent i’s belief based on hi
610
+ t even when he plays
611
+ an arbitrary strategy ˆgi, not necessarily the same as gi or ˜gi, provided that
612
+ agents −i play g−i.
613
+ Lemma 1. For hi
614
+ t such that Pˆgi,g−i(hi
615
+ t) > 0, we have P˜gi,g−i(hi
616
+ t) > 0 and
617
+ Pˆgi,g−i(xt, s−i
618
+ t
619
+ | hi
620
+ t) = P˜gi,g−i(xt, s−i
621
+ t
622
+ | hi
623
+ t) = P˜gi,g−i(xt, s−i
624
+ t
625
+ | si
626
+ t, ct).
627
+ (11)
628
+ Proof Note that P˜gi(ai
629
+ t) = 1/|Ai
630
+ t|, so P˜gi,g−i(hi
631
+ t) > 0 given that Pg(hi
632
+ t) > 0. Then
633
+ from part (i) of the definition of sufficient private information and part (i) of Theorem
634
+ 1 in Tavafoghi et al (2022) we have
635
+ Pˆgi,g−i
636
+ (xt, s−i
637
+ t
638
+ | hi
639
+ t) =
640
+
641
+ h−i
642
+ t
643
+ :ζ−i
644
+ t
645
+ (h−i
646
+ t
647
+ )=s−i
648
+ t
649
+ Pˆgi,g−i
650
+ (xt, h−i
651
+ t
652
+ | hi
653
+ t)
654
+ =
655
+
656
+ h−i
657
+ t
658
+ :ζ−i
659
+ t
660
+ (h−i
661
+ t
662
+ )=s−i
663
+ t
664
+ P˜gi,g−i
665
+ (xt, h−i
666
+ t
667
+ | hi
668
+ t)
669
+ = P˜gi,g−i
670
+ (xt, s−i
671
+ t
672
+ | hi
673
+ t).
674
+ (12)
675
+ Furthermore, from condition (iii) of the definition of sufficient private information
676
+ we have
677
+ P˜gi,g−i
678
+ (xt, s−i
679
+ t
680
+ | hi
681
+ t) = P˜gi,g−i
682
+ (xt, s−i
683
+ t
684
+ | si
685
+ t, ct).
686
+ (13)
687
+
688
+
689
+ Springer Nature 2021 LATEX template
690
+ 12
691
+ Dynamic Games with Asymmetric Information and Hidden Actions
692
+ 4.2 CIB Belief System (Step 2)
693
+ Given the compressed private information, we next compress the agents’ com-
694
+ mon information in the form of a belief system. We call such a compressed
695
+ belief system the Common Information Based (CIB) belief system. Similar to
696
+ Tang et al (2022); Ouyang et al (2017), the CIB belief system is sufficient
697
+ for decision-making if it is common knowledge among all agents, and every
698
+ agent i can compute his belief about the system state and the other agents’
699
+ sufficient private information using the CIB belief system and his compressed
700
+ private information. More specifically, agent i should be able to compute
701
+ Pˆgi,g−i(xt, st | hi
702
+ t) using the CIB belief system and his sufficient private infor-
703
+ mation si
704
+ t whenever other agents follow the strategy profile g−i and agent i
705
+ plays an arbitrary strategy ˆgi.
706
+ To determine a CIB belief system that satisfies the above sufficiency
707
+ requirement we proceed as follows. We first define N CIB belief systems Πψ :=
708
+ {Πψ,1, Πψ,2, . . . , Πψ,N}, one for each agent (Definition 2 below). Each belief
709
+ system Πψ,i consists of a sequence of PMFs on Xt × St that are sequentially
710
+ updated according to an update rule ψ = (ψ1, ψ2, . . . , ψN) that is common
711
+ knowledge among the agents; for each realization ct of the common information
712
+ available at t, πψ,i
713
+ t
714
+ describes the belief on Xt×St based on ct from agent i’s point
715
+ of view. We want πψ,i
716
+ t
717
+ , combined with si
718
+ t, to enable agent i to form his own suf-
719
+ ficient information-based private belief (given by Pˆgi,g∗−i(xt, st | si
720
+ t, ct)) about
721
+ the current status of the game. Furthermore, we want the CIB belief system
722
+ to capture the current status of the game when agents utilize strategies based
723
+ on (St, Πψ
724
+ t ). For that matter, we define the notion/concept of Sufficient Infor-
725
+ mation Based (SIB) strategy profile σ := (σi, i ∈ N), σi := (σi
726
+ t, t ∈ T ), i ∈ N.
727
+ Each component σi
728
+ t of σ is a function of si
729
+ t, agent i’s sufficient private infor-
730
+ mation at t, and πψ
731
+ t = (πψ,i
732
+ t
733
+ , i ∈ N) (see Definition 3 below). Using the N
734
+ CIB belief systems and the SIB strategy profile σ we define update equations
735
+ for each πψ,i
736
+ t
737
+ so that each πψ,i
738
+ t
739
+ is consistent with si
740
+ t and with agent i’s suffi-
741
+ cient private information-based belief Pˆgi,g∗−i(xt, st | si
742
+ t, ct), defined in Section
743
+ 4.1 (Definition 1), and each πψ,i
744
+ t
745
+ is common knowledge among all agents (see
746
+ Definition 4 below). We proceed with the (formal) definitions.
747
+ Definition 2 (Common information based (CIB) belief system). Given a
748
+ sequence of update functions ψ = {ψi
749
+ t, i ∈ N, t ∈ T } that are common
750
+ knowledge among the N agents, sequentially define
751
+ Πψ,i
752
+ t
753
+ = ψi
754
+ t(Πψ
755
+ t−1, Zt), i ∈ N, t ∈ T
756
+ (14)
757
+ where
758
+ Πψ
759
+ t :=
760
+
761
+ 
762
+ Πψ,1
763
+ t
764
+ ...
765
+ Πψ,N
766
+ t
767
+
768
+  , t ∈ T
769
+ (15)
770
+
771
+ Springer Nature 2021 LATEX template
772
+ Dynamic Games with Asymmetric Information and Hidden Actions
773
+ 13
774
+ Πψ
775
+ 0 :=
776
+
777
+ 
778
+ µ0
779
+ ...
780
+ µ0
781
+
782
+ 
783
+ (16)
784
+ The sequence Πψ
785
+ 1:T = (Πψ
786
+ 1 , Πψ
787
+ 2 , . . . , Πψ
788
+ T ) defines a CIB belief system; Πψ,i
789
+ t
790
+ denotes the CIB belief over Xt × St based on Ct from agent i’s point of view.
791
+ Definition 3 (SIB strategy). Given a CIB belief system Πψ
792
+ 1:T , we define a
793
+ Sufficient Information Based (SIB) strategy profile σ := (σ1, σ2, . . . , σN), σi :=
794
+ (σi
795
+ 1, σi
796
+ 2, . . . , σi
797
+ T ) by the maps
798
+ σi
799
+ t : Si
800
+ t × [∆(Xt × St)]N → ∆(At), t = 1, 2, . . . , i = 1, 2, . . . , N.
801
+ (17)
802
+ Based on Definitions 2 and 3 we present a set of conditions that an indi-
803
+ vidual CIB belief system (Πψ,i
804
+ t
805
+ , t ∈ T ) must satisfy so as to ensure that each
806
+ agent i can form his own (private) belief about the current status of the game,
807
+ given by (Xt, St), using Πψ
808
+ t and Si
809
+ t when all other agents −i employ SIB strate-
810
+ gies σ−i. This set of conditions describe a sequential update rule of Πψ,i
811
+ t
812
+ ; the
813
+ update rule depends on whether or not the (new) common observation at t is
814
+ feasible under the agents’ strategies.
815
+ Definition 4 (Consistent CIB belief system). Consider a SIB strategy
816
+ profile σ. Let F i
817
+ t (xt+1, st+1, zt+1)(πψ
818
+ t ;
819
+ σ−i
820
+ t ) denote the CIB belief about
821
+ (xt+1, st+1, zt+1) constructed recursively by assuming that (i) (xt, st) is dis-
822
+ tributed according to πψ,i
823
+ t
824
+ (ii) agent i employs the uniform strategy ˜gi at t (i.e.,
825
+ the strategy that chooses every action ai
826
+ t ∈ Ai
827
+ t with equal probability), and (iii)
828
+ agent −i plays according σ−i
829
+ t . That is,
830
+ F i
831
+ 0(x1, s1, z1) =
832
+
833
+ y1
834
+
835
+ P{z1, y1 | x1}µ0(x1)
836
+ ��
837
+ j
838
+ 1{sj
839
+ 1 = φj
840
+ 1(z1, yj
841
+ 1)}
842
+ � �
843
+ (18)
844
+ at t = 1, and for t ≥ 1.
845
+ F i
846
+ t (xt+1, st+1, zt+1)(πψ
847
+ t ; σ−i
848
+ t )
849
+ =
850
+
851
+ yt+1,xt,st,at
852
+
853
+ P{zt+1, yt+1, xt+1 | xt, at}
854
+ ��
855
+ j
856
+ 1{sj
857
+ t+1 = φj
858
+ t+1(sj
859
+ t, zt+1, yj
860
+ t+1, aj
861
+ t)}
862
+
863
+
864
+
865
+ 1
866
+ | Ai
867
+ t |
868
+
869
+ j̸=i
870
+ σj
871
+ t (aj
872
+ t)(πψ
873
+ t , sj
874
+ t)
875
+
876
+  πψ,i
877
+ t
878
+ (xt, st)
879
+
880
+ (19)
881
+ We define the update rule ψσ = (ψσ,i
882
+ t , i ∈ N, t ∈ T ) and the corresponding
883
+ CIB belief system Πψσ
884
+ 1:T as follows. At any t
885
+
886
+ Springer Nature 2021 LATEX template
887
+ 14
888
+ Dynamic Games with Asymmetric Information and Hidden Actions
889
+ (i) If �
890
+ ˆxt+1,ˆst+1 F i
891
+ t (ˆxt+1, ˆst+1, zt+1)(πψσ
892
+ t
893
+ ; σ−i
894
+ t ) > 0 (i.e. the new common
895
+ observation zt+1 is feasible from the agent i’s point of view), then πψσ,i
896
+ t+1
897
+ can be updated recursively as
898
+ πψσ,i
899
+ t+1 (xt+1, st+1) =
900
+ F i
901
+ t (xt+1, st+1, zt+1)(πψσ
902
+ t
903
+ ; σ−i
904
+ t )
905
+
906
+ ˆxt+1,ˆst+1 F i
907
+ t (ˆxt+1, ˆst+1, zt+1)(πψσ
908
+ t
909
+ ; σ−i
910
+ t )
911
+ ,
912
+ (20)
913
+ via Bayes rule.
914
+ (ii) If �
915
+ ˆxt+1,ˆst+1 F i
916
+ t (ˆxt+1, ˆst+1, zt+1)(πψσ
917
+ t
918
+ ; σ−i
919
+ t ) = 0 (i.e. the new common
920
+ observation zt+1 is infeasible from the agent i’s point of view), then the
921
+ update rule is
922
+ πψσ,i
923
+ t+1 (xt+1, st+1) =
924
+ 1
925
+ |Xt+1 × St+1|.
926
+ (21)
927
+ Based on (20) and (21) we can write
928
+ Πψσ,i
929
+ t+1 = ψσ,i
930
+ t+1(Πψσ
931
+ t , Zt+1).
932
+ (22)
933
+ Πψσ
934
+ t+1 = ψσ
935
+ t+1(Πψσ
936
+ t , Zt+1).
937
+ (23)
938
+ Furthermore,
939
+ for
940
+ all
941
+ i
942
+
943
+ N,
944
+ each
945
+ agent
946
+ can
947
+ determine
948
+ if
949
+
950
+ ˆxt+1,ˆst+1 F i
951
+ t (ˆxt+1, ˆst+1, zt+1)(πσψ
952
+ t
953
+ ; σ−i
954
+ t ) is positive or zero; thus each agent
955
+ knows how agent i computes πψσ,i
956
+ t+1 from σi
957
+ t, zt+1, σ−i
958
+ t
959
+ and ψσ. Therefore, πψσ,i
960
+ t
961
+ (hence πψσ
962
+ t
963
+ ) is common knowledge among all agents. We call Πψσ
964
+ 1:T the CIB
965
+ belief system consistent with the SIB strategy profile σ.
966
+ Remark 2. Since the sufficient private information is a function of the agent’s
967
+ available information, a SIB strategy σi
968
+ t corresponds to a strategy gi,σ
969
+ t
970
+ given
971
+ by gi,σ
972
+ t (hi
973
+ t) := σi
974
+ t(ζi
975
+ t(hi
976
+ t), πψσ
977
+ t
978
+ ). Therefore, in the rest of the paper we use the
979
+ following convention: Pσ(·) = Pgσ(·) and Eσ[·] = Egσ[·].
980
+ Remark 3. There are many alternative specifications of the update rule
981
+ ψσ
982
+ t , t ∈ T defined by (22)-(23), that result in consistent CIB belief systems,
983
+ that is, CIB belief systems which ensure that (i) agent i can form his pri-
984
+ vate belief over (Xt, S−i
985
+ t ) by incorporating his private sufficient information
986
+ Si
987
+ t into his CIB belief Πψσ,i
988
+ t
989
+ given that agents −i play according to σ−i,
990
+ (ii) agent i’s private belief formed according to i is identical to the prob-
991
+ ability distribution over (Xt, S−i
992
+ t ) conditional on his complete history Hi
993
+ t
994
+ even when he plays an arbitrary strategy ˆgi different from σi. An example
995
+ of such an alternative update rule is described by (20) (Bayes’ rule) when
996
+
997
+ ˆxt+1,ˆst+1 F i
998
+ t (ˆxt+1, ˆst+1, zt+1)(πψσ
999
+ t
1000
+ ; σ−i
1001
+ t ) > 0 and a arbitrary PMF πψσ,i
1002
+ t+1 (·, ·)
1003
+ on Xt+1 × St+1 when �
1004
+ ˆxt+1,ˆst+1 F i
1005
+ t (ˆxt+1, ˆst+1, zt+1)(πψσ
1006
+ t
1007
+ ; σ−i
1008
+ t ) = 0.
1009
+
1010
+ Springer Nature 2021 LATEX template
1011
+ Dynamic Games with Asymmetric Information and Hidden Actions
1012
+ 15
1013
+ Definition 4 ensures that agent i can form his beliefs over (Xt, S−i
1014
+ t ) by
1015
+ incorporating his sufficient private information Si
1016
+ t into his CIB belief Πψσ,i
1017
+ t
1018
+ given that agents −i play according to σ−i. Moreover, this belief is sufficient to
1019
+ compute the probability distribution over (Xt, S−i
1020
+ t ) conditional on his complete
1021
+ history Hi
1022
+ t even when he plays an arbitrary strategy ˆgi different from σi.
1023
+ We formalize the above discussion in Lemma 2 below, by using the notation
1024
+ Pˆgi,σ−i,ψσ(·) to indicate the belief resulting when agent i plays ˆgi and agents
1025
+ −i play g−i,σ(h−i
1026
+ t ) = σ−i
1027
+ t (ζ−i
1028
+ t (h−i
1029
+ t ), πψσ
1030
+ t
1031
+ ) using the update rule ψσ .
1032
+ Lemma 2. Consider a SIB strategy profile σ, along with an associated consis-
1033
+ tent CIB belief system Πψσ
1034
+ t . Suppose (xt, hi
1035
+ t, h−i
1036
+ t
1037
+ is a realization with positive
1038
+ probability under (ˆgi, σ−i), where ˆgi denotes an arbitrary strategy for agent
1039
+ i. Let si
1040
+ t = ζi
1041
+ t(hi
1042
+ t) and s−i
1043
+ t
1044
+ = ζ−i
1045
+ t (h−i
1046
+ t ) be the associated sufficient private
1047
+ information. Then agent i’s belief at time t can be computed using πψσ
1048
+ t
1049
+ as
1050
+ Pˆgi,σ−i,ψσ(xt, s−i
1051
+ t
1052
+ | hi
1053
+ t) =
1054
+ πψσ,i
1055
+ t
1056
+ (xt, st)
1057
+
1058
+ s−i
1059
+ t
1060
+ ,xt πψσ,i
1061
+ t
1062
+ (xt, si
1063
+ t, s−i
1064
+ t )
1065
+ (24)
1066
+ Proof From Lemma 1 we have
1067
+ Pˆgi,σ−i,ψσ
1068
+ (xt, s−i
1069
+ t
1070
+ | hi
1071
+ t) = P˜gi,σ−i,ψσ
1072
+ (xt, s−i
1073
+ t
1074
+ | hi
1075
+ t). = P˜gi,σ−i,ψσ
1076
+ (xt, s−i
1077
+ t
1078
+ | ct, si
1079
+ t).
1080
+ (25)
1081
+ By Bayes’ rule we obtain
1082
+ P˜gi,σ−i,ψσ
1083
+ (xt, s−i
1084
+ t
1085
+ | ct, si
1086
+ t) = P˜gi,σ−i,ψσ(xt, st | ct)
1087
+ P˜gi,σ−i,ψσ(si
1088
+ t | ct)
1089
+ =
1090
+ πψσ,i
1091
+ t
1092
+ (xt, st)
1093
+
1094
+ s−i
1095
+ t
1096
+ ,xt πψσ,i
1097
+ t
1098
+ (xt, si
1099
+ t, s−i
1100
+ t )
1101
+ .
1102
+ (26)
1103
+ Combination of (25) and (26) establishes the assertion of Lemma 2.
1104
+
1105
+ Remark 4. Suppose Xt = (X1
1106
+ t , X2
1107
+ t , . . . . , XN
1108
+ t ) and we have the conditional
1109
+ independence property, namely, that for any strategy profile g Pg(xt, st | ct) =
1110
+
1111
+ i Pgi(xi
1112
+ t, si
1113
+ t | ct). Then one can show for any i that
1114
+ πψσ,i
1115
+ t
1116
+ (xt, st) =
1117
+
1118
+ j
1119
+ πψσ,i(xj
1120
+ t, sj
1121
+ t) = P˜gi
1122
+ t(xi
1123
+ t, si
1124
+ t | ct)
1125
+
1126
+ j̸=i
1127
+ Pσj(xj
1128
+ t, sj
1129
+ t | ct)
1130
+ Therefore, for settings with the conditional independence property as in Tang
1131
+ et al (2022); Ouyang et al (2017), one can use the simplified beliefs P˜gi
1132
+ t(xi
1133
+ t, si
1134
+ t |
1135
+ ct) and Pσj(xj
1136
+ t, sj
1137
+ t | ct) as the compressed common information to compute
1138
+ the CIB belief πψσ,i
1139
+ t
1140
+ (xt, st). The conditional independence among the system
1141
+ components in the models of Tang et al (2022); Ouyang et al (2017) could be
1142
+ lost when the agents’ actions are not observable.
1143
+
1144
+ Springer Nature 2021 LATEX template
1145
+ 16
1146
+ Dynamic Games with Asymmetric Information and Hidden Actions
1147
+ 5
1148
+ Sequential decomposition (Step 3)
1149
+ In this section we present a sequential decomposition of the game, that is, a
1150
+ backward inductive sequential procedure that determines a Sufficient Informa-
1151
+ tion Based Bayesian Nash Equilibrium (SIB-BNE), defined below, if each step
1152
+ of this procedure has a solution. We proceed as follows. We first establish a
1153
+ key closedness of best response property (Section 5.1); we use this property to
1154
+ provide a sequential decomposition of the game (Section 5.2)
1155
+ Definition
1156
+ 5
1157
+ (SIB-BNE).
1158
+ Consider
1159
+ a
1160
+ SIB
1161
+ strategy
1162
+ profile
1163
+ σ∗
1164
+ =
1165
+ (σ∗1, σ∗2, . . . , σ∗n) and its corresponding consistent update rule ψσ∗. The SIB
1166
+ strategy profile σ∗ is a SIB-BNE if it is a BNE of the dynamic game. That is,
1167
+ for all i ∈ N,
1168
+ Eˆgi,σ∗−i,ψσ∗
1169
+ {U i(X1:T , A1:T )} ≤ Eσ∗,ψσ∗
1170
+ {U i(X1:T , A1:T )},
1171
+ for all strategies (not necessarily SIB strategies) ˆgi.
1172
+ (27)
1173
+ 5.1 Closedness of best response
1174
+ The key result of this subsection is presented in the following theorem.
1175
+ Theorem 1. Consider a fixed and known SIB strategy profile σ and the cor-
1176
+ responding update rule ψσ. Suppose agents −i use σ−i with ψσ. Then, there
1177
+ exists a SIB strategy ˆσi that uses ψσ and is a best response to σ−i with ψσ.
1178
+ The proof is based on Lemmas 3, 4, and 5 that we state and prove below.
1179
+ Lemma 3. Consider a SIB strategy profile σ and the corresponding update
1180
+ rule ψσ along with the consistent CIB belief system Πψσ
1181
+ 1:T .
1182
+ If agents −i play according to the SIB strategies σ−i and use the update
1183
+ rule ψσ, the best response problem for agent i is a POMDP with state and
1184
+ observation processes
1185
+ ˜Xt = (St, Πψσ
1186
+ t , Xt), t ∈ T
1187
+ (28)
1188
+ ˜Yt = (Y i
1189
+ t , Zt), t ∈ T
1190
+ (29)
1191
+ respectively, and instantaneous utility
1192
+ ˜ui
1193
+ t( ˜Xt, Ai
1194
+ t) =
1195
+
1196
+ a−i
1197
+ t
1198
+ � �
1199
+ j̸=i
1200
+ σj
1201
+ t (aj
1202
+ t | Sj
1203
+ t , Πψσ
1204
+ t )
1205
+
1206
+ ui
1207
+ t(Xt, a−i
1208
+ t , Ai
1209
+ t), t ∈ T
1210
+ (30)
1211
+ The assertion of Lemma 3 is a direct consequence of Lemmas 4 and 5.
1212
+ Lemma 4. Consider a SIB strategy profile σ and the corresponding update
1213
+ rule ψσ. Suppose agents −i play according to the SIB strategies σ−i using ψσ
1214
+
1215
+ Springer Nature 2021 LATEX template
1216
+ Dynamic Games with Asymmetric Information and Hidden Actions
1217
+ 17
1218
+ and agent i follows an arbitrary strategy ˆgi (not necessarily a SIB strategy).
1219
+ Then
1220
+ Pˆgi,σ−i,ψσ(˜xt+1, ˜yt+1 | ˜x1:t, ˜y1:t, ai
1221
+ 1:t) = Pˆgiσ−i,ψσ(˜xt+1, ˜yt+1 | ˜xt, ai
1222
+ t)
1223
+ (31)
1224
+ Proof The probability for the next state and observation ˜xt+1, ˜yt+1 can be computed
1225
+ by
1226
+ Pˆgi,σ−i,ψσ
1227
+ (˜xt+1, ˜yt+1 | ˜x1:t, ˜y1:t, ai
1228
+ 1:t)
1229
+ = Pˆgi,σ−i,ψσ
1230
+ (xt+1, πψσ
1231
+ t+1, st+1, yi
1232
+ t+1, zt+1 | x1:t, πψσ
1233
+ 1:t , s1:t, yi
1234
+ 1:t, z1:t, ai
1235
+ 1:t)
1236
+ =
1237
+
1238
+ y−i
1239
+ t+1,a−i
1240
+ t
1241
+ Pˆgi,σ−i,ψσ
1242
+ (xt+1, πψσ
1243
+ t+1, st+1, yt+1, zt+1, a−i
1244
+ t
1245
+ | x1:t, πψσ
1246
+ 1:t , s1:t, yi
1247
+ 1:t, z1:t, ai
1248
+ 1:t)
1249
+ =
1250
+
1251
+ y−i
1252
+ t+1,a−i
1253
+ t
1254
+ � �
1255
+ j
1256
+ 1(sj
1257
+ t+1 = φj
1258
+ t+1(sj
1259
+ t, yj
1260
+ t+1, zt+1, aj
1261
+ t))
1262
+
1263
+ P{zt+1, yt+1, xt+1 | xt, at}
1264
+ 1(πψσ
1265
+ t+1 = ψσ
1266
+ t+1(πψσ
1267
+ t
1268
+ , zt+1))
1269
+ � �
1270
+ j̸=i
1271
+ σj
1272
+ t (aj
1273
+ t | sj
1274
+ t, πψσ
1275
+ t
1276
+ )
1277
+
1278
+ (32)
1279
+ where the last equality follows from the system dynamics, part (ii) of Definition 1,
1280
+ Definition 4, and the form of SIB strategies of agents −i. Since the right hand side
1281
+ of (32) depends only on (˜xt, ai
1282
+ t) we conclude that
1283
+ Pˆgi,σ−i,ψσ
1284
+ (˜xt+1, ˜yt+1 | ˜x1:t, ˜y1:t, ai
1285
+ 1:t) = Pˆgi,σ−i,ψσ
1286
+ (˜xt+1, ˜yt+1 | ˜xt, ai
1287
+ t)
1288
+ (33)
1289
+
1290
+ Lemma 4 shows that { ˜Xt, ˜Yt, t ∈ T } is a Markov process conditional on
1291
+ {Ai
1292
+ t, t ∈ T }
1293
+ Lemma 5. Consider a SIB strategy profile σ and the corresponding update
1294
+ rule ψσ. Suppose agents −i follow the SIB strategies σ−i using ψσ and agent i
1295
+ follows an arbitrary strategy ˆgi (not necessarily a SIB strategy). Then there are
1296
+ utility functions ˜ui
1297
+ t such that Eˆgi,σ−i,ψσ[˜ui
1298
+ t( ˜Xt, Ai
1299
+ t)] = Eˆgi,σ−i,ψσ[ui
1300
+ t(Xt, At)]
1301
+ for all t ∈ T .
1302
+ Proof Recall that ˜
1303
+ Xt = (St, Πψσ
1304
+ t
1305
+ , Xt). Then
1306
+ Eˆgi,σ−i,ψσ
1307
+ [ui
1308
+ t(Xt, At)]
1309
+ = Eˆgi,σ−i,ψσ
1310
+ [ui
1311
+ t(Xt, A−i
1312
+ t , Ai
1313
+ t)]
1314
+ = Eˆgi,σ−i,ψσ �
1315
+ Eˆgi,σ−i,ψσ
1316
+ [ui
1317
+ t(Xt, A−i
1318
+ t , Ai
1319
+ t) | ˜
1320
+ Xt, Ai
1321
+ t]
1322
+
1323
+ = Eˆgi,σ−i,ψσ � �
1324
+ a−i
1325
+ t
1326
+ Pˆgi,σ−i,ψσ
1327
+ (a−i
1328
+ t
1329
+ | St, Πψσ
1330
+ t
1331
+ , Xt, Ai
1332
+ t)ui
1333
+ t(Xt, a−i
1334
+ t , Ai
1335
+ t)]
1336
+
1337
+ = Eˆgi,σ−i,ψσ � �
1338
+ a−i
1339
+ t
1340
+ � �
1341
+ j̸=i
1342
+ σj
1343
+ t (aj
1344
+ t | Sj
1345
+ t , Πψσ
1346
+ t
1347
+ )
1348
+
1349
+ ui
1350
+ t(Xt, a−i
1351
+ t , Ai
1352
+ t)]
1353
+
1354
+ (34)
1355
+
1356
+ Springer Nature 2021 LATEX template
1357
+ 18
1358
+ Dynamic Games with Asymmetric Information and Hidden Actions
1359
+ Therefore, we establish the claim of the lemma by defining
1360
+ ˜ui
1361
+ t( ˜Xt, Ai
1362
+ t) =
1363
+
1364
+ a−i
1365
+ t
1366
+ � �
1367
+ j̸=i
1368
+ σj
1369
+ t (aj
1370
+ t | Sj
1371
+ t , Πψσ
1372
+ t
1373
+ )
1374
+
1375
+ ui
1376
+ t(Xt, a−i
1377
+ t , Ai
1378
+ t)]
1379
+ (35)
1380
+
1381
+ Proof of Theorem 1 From Lemma 3 we conclude that the best response of agent
1382
+ i to σ−i is a POMDP with state ˜Xt. From the theory of POMDP (Kumar and
1383
+ Varaiya, 1986, Chapter 6) we know that: (i) the belief on the state ˜
1384
+ Xt = (St, Πψσ
1385
+ t
1386
+ , Xt)
1387
+ conditioned on available information hi
1388
+ t is an information state for the agent; (ii)
1389
+ for each t ∈ T there exists an optimal strategy for agent i that is a function of the
1390
+ information state at t. We now prove that (Si
1391
+ t, Πψσ
1392
+ t
1393
+ ) is an information state for agent
1394
+ i at t, t ∈ T .
1395
+ We note that Si
1396
+ t+1 = φi
1397
+ t(Si
1398
+ t, Y i
1399
+ t+1, Zt+1, Ai
1400
+ t) from part (ii) of Definition 1, and Πψσ
1401
+ t+1 =
1402
+ ψσ
1403
+ t+1(Πψσ
1404
+ t
1405
+ , Zt+1) from (23).
1406
+ Thus, we only need to show that for any strategy ˆgi and any realization hi
1407
+ t such
1408
+ that Pˆgi,σ−i,ψσ(hi
1409
+ t) > 0 the following equality is true:
1410
+ Pˆgi,σ−i,ψσ
1411
+ (st, πψσ
1412
+ t
1413
+ , xt | hi
1414
+ t) = Pˆgi,σ−i,ψσ
1415
+ (st, πψσ
1416
+ t
1417
+ , xt | si
1418
+ t, πψσ
1419
+ t
1420
+ )
1421
+ (36)
1422
+ For that matter, we note that si
1423
+ t, πψσ
1424
+ t
1425
+ are perfectly known to agent i. Furthermore,
1426
+ from the definition of sufficient private information and Lemma 2 we have
1427
+ Pˆgi,σ−i,ψσ
1428
+ (s−i
1429
+ t , xt | hi
1430
+ t) =
1431
+ πψσ,i
1432
+ t
1433
+ (st, xt)
1434
+
1435
+ s−i
1436
+ t
1437
+ ,xt πψσ,i
1438
+ t
1439
+ (si
1440
+ t, s−i
1441
+ t , xt)
1442
+ ,
1443
+ (37)
1444
+ which is a function of (si
1445
+ t, πψσ
1446
+ t
1447
+ ). Therefore,
1448
+ Pˆgi,σ−i,ψσ
1449
+ (st, πψσ
1450
+ t
1451
+ , xt | hi
1452
+ t) = 1(si
1453
+ t = ζi
1454
+ t(hi
1455
+ t))1(πψσ
1456
+ t
1457
+ = γψσ
1458
+ (hi
1459
+ t)) Pˆgi,σ−i,ψσ
1460
+ (s−i
1461
+ t , xt | pi
1462
+ t, ct)
1463
+ (38)
1464
+ where γψσ(hi
1465
+ t) = ψσ
1466
+ t (ψσ
1467
+ t−1, · · · ) is the composition of ψσ from 1 to t. Then, equation
1468
+ (36) is true because of (37) and (38). Consequently, (Si
1469
+ t, Πψσ
1470
+ t
1471
+ ), t ∈ T is an information
1472
+ state for the best response problem for agent i and the assertion of Theorem 1 is
1473
+ true.
1474
+
1475
+ As a result of Theorem 1, a definition of SIB BNE equivalent to Definition
1476
+ 5 is the following
1477
+ Definition 6 (Equivalent definition of SIB BNE). Consider a SIB strategy
1478
+ profile σ∗ = (σ∗1, σ∗2, . . . , σ∗n) and its corresponding consistent update rule
1479
+ ψσ∗. The SIB strategy profile σ∗ is a SIB BNE if for all i ∈ N,
1480
+ Eσi,σ∗−i,ψσ∗
1481
+ {U i(X1:T , A1:T )} ≤ Eσ∗,ψσ∗
1482
+ {U i(X1:T , A1:T )}
1483
+ (39)
1484
+ for all σi ∈ Λi where Λi is the set of SIB strategy profiles of agent i.
1485
+
1486
+ Springer Nature 2021 LATEX template
1487
+ Dynamic Games with Asymmetric Information and Hidden Actions
1488
+ 19
1489
+ A consequence of Lemmas 3-5 and Theorem 1 is the following. Consider
1490
+ a SIB strategy profile σ, the corresponding update rule ψσ along with the
1491
+ consistent CIB belief system Πψσ
1492
+ 1:T ; if agents −i play according to σ−i, then the
1493
+ best response of agent i could be determined by the dynamic program
1494
+ ˘V i
1495
+ T +1(·, ·) = 0 for all i
1496
+ (40)
1497
+ ˘V i
1498
+ t (πψσ
1499
+ t
1500
+ , si
1501
+ t) = max
1502
+ ˜σi
1503
+ t∈Λi
1504
+ t
1505
+ E˜σi
1506
+ t,σ−i
1507
+ t
1508
+ ,ψσ{ui
1509
+ t(Xt, At) + ˘V i
1510
+ t+1(ψσ
1511
+ t+1(πψσ
1512
+ t
1513
+ , Zt+1), Si
1514
+ t+1) | si
1515
+ t},
1516
+ ∀πψσ
1517
+ t
1518
+ ∈ ∆(Xt × St)N, ∀si
1519
+ t ∈ Si
1520
+ s, t ∈ T
1521
+ (41)
1522
+ where Λi
1523
+ t is the set of SIB strategies of agent i at time t.
1524
+ 5.2 Sequential decomposition
1525
+ Given a set of value functions Vt+1 = {V i
1526
+ t+1 : Πt+1 × Si
1527
+ t+1 → R, i ∈ N}, a SIB
1528
+ strategy profile σ, the corresponding update rule ψσ
1529
+ t+1 defined by (23), and the
1530
+ consistent CIB belief πψσ
1531
+ t
1532
+ , define the stage-game Gt(Vt+1, πψσ
1533
+ t
1534
+ ) as follows.
1535
+ (i) There are N agents. (ii) The system state is Xt. (iii) Each agent i
1536
+ observes private information Si
1537
+ t and common information πψσ
1538
+ t
1539
+ . (iv) Agent i’s
1540
+ belief about the state Xt and other agents’ private information S−i
1541
+ t
1542
+ is given
1543
+ by πψσ,i
1544
+ t
1545
+ (xt, s−i
1546
+ t ), that is,
1547
+ πψσ,i
1548
+ t
1549
+ (xt, s−i
1550
+ t ) ∈ ∆(Xt × S−i
1551
+ t ).
1552
+ (42)
1553
+ (v) Each agent i selects action Ai
1554
+ t based on his available information; let ˆσi
1555
+ t
1556
+ denote agent i’s strategy for this stage-game; then,
1557
+ Pˆσt,ψσ(Ai
1558
+ t = ai
1559
+ t | si
1560
+ t, πψσ
1561
+ t
1562
+ ) = ˆσi
1563
+ t(ai
1564
+ t | si
1565
+ t, πψσ
1566
+ t
1567
+ ).
1568
+ (43)
1569
+ (vi) Each agent i has utility
1570
+ U i
1571
+ Gt(Vt+1,πψσ
1572
+ t
1573
+ ) = ui
1574
+ t(Xt, At) + V i
1575
+ t+1(ψσ
1576
+ t+1(πψσ
1577
+ t
1578
+ , Zt+1), Si
1579
+ t+1)
1580
+ (44)
1581
+ where (Zt+1, Si
1582
+ t+1) conditioned on (Xt, St, At) follows the conditional proba-
1583
+ bility �
1584
+ xt+1,s−i
1585
+ t+1 P(zt+1, xt+1, st+1 | xt, st, at) and the conditional probability
1586
+ P(zt+1, xt+1, st+1 | xt, st, at) is given by
1587
+ P(zt+1, xt+1, st+1 | xt, st, at)
1588
+ =
1589
+
1590
+ yt+1
1591
+ P{xt+1 | xt, at}P{zt+1, yt+1 | xt+1, at}
1592
+ ��
1593
+ j
1594
+ 1{sj
1595
+ t+1 = φj
1596
+ t+1(sj
1597
+ t, zt+1, yj
1598
+ t+1, aj
1599
+ t)}
1600
+
1601
+ (45)
1602
+
1603
+ Springer Nature 2021 LATEX template
1604
+ 20
1605
+ Dynamic Games with Asymmetric Information and Hidden Actions
1606
+ (vii) Given a strategy profile ˆσt for the stage-game, the expected utility of
1607
+ each player i is given by
1608
+ Eˆσt,ψσ[U i
1609
+ Gt(Vt+1,πψσ
1610
+ t
1611
+ ) | si
1612
+ t]
1613
+ =
1614
+
1615
+ xt,s−i
1616
+ t
1617
+ ,at,zt+1,xt+1,st+1
1618
+ πψσ,i
1619
+ t
1620
+ (xt, s−i
1621
+ t )
1622
+
1623
+ j
1624
+ ˆσj
1625
+ t (ai
1626
+ t | si
1627
+ t, πψσ
1628
+ t
1629
+ ) P(zt+1, xt+1, st+1 | xt, st, at)
1630
+ (ui
1631
+ t(xt, at) + V i
1632
+ t+1(ψσ
1633
+ t+1(πψσ
1634
+ t
1635
+ , zt+1), si
1636
+ t+1))
1637
+ (46)
1638
+ Note that all the random variables of the stage-game Gt(Vt+1, πψσ
1639
+ t
1640
+ ) may
1641
+ not necessarily be the same as their counterparts in the original dynamic game
1642
+ since each agent i is allowed to choose an arbitrary SIB strategy ˆσi
1643
+ t which may
1644
+ be different from σi
1645
+ t specified by the SIB strategy profile σ. The stage-game
1646
+ random variables will coincide with their counterparts in the original game if
1647
+ all agents follow σ.
1648
+ Theorem 2 (Sequential decomposition). Consider a SIB strategy profile σ =
1649
+ {σt, t ∈ T } and the corresponding update rule ψσ = {ψσ
1650
+ t , t ∈ T } defined by
1651
+ (22)-(23). Define
1652
+ V i
1653
+ T +1(·, ·) = 0 for all i
1654
+ (47)
1655
+ V i
1656
+ t (πψσ
1657
+ t , si
1658
+ t) = Eσt,ψσ[U i
1659
+ Gt(Vt+1,πψσ
1660
+ t
1661
+ ) | si
1662
+ t]
1663
+ (48)
1664
+ where the right hand side of (48) is given by (46). If for all t ∈ T , there is a
1665
+ SIB strategy profile ˆσt such that ˆσt is a BNE of the stage-game Gt(Vt+1, πψσ
1666
+ t
1667
+ ),
1668
+ that is,
1669
+ Eˆσi
1670
+ t,ˆσ−i
1671
+ t
1672
+ ,ψσ[U i
1673
+ Gt(Vt+1,πψσ
1674
+ t
1675
+ ) | si
1676
+ t] = max
1677
+ ˜σi
1678
+ t∈Λi
1679
+ t
1680
+ E˜σi
1681
+ t,ˆσ−i
1682
+ t
1683
+ ,ψσ[U i
1684
+ Gt(Vt+1,πψσ
1685
+ t
1686
+ ) | si
1687
+ t]
1688
+ (49)
1689
+ for all i ∈ N where Λi
1690
+ t is the set of SIB strategies of agent i at time t, and
1691
+ ˆσt = σt,
1692
+ (50)
1693
+ then the SIB strategy profile σ is a SIB-BNE of the original dynamic game.
1694
+ Proof Suppose that for all t ∈ T there is a SIB strategy profile ˆσt = (ˆσ1
1695
+ t , ˆσ2
1696
+ t , . . . , ˆσN
1697
+ t )
1698
+ that is a BNE of the stage game Gt(Vt+1, πψσ
1699
+ t
1700
+ ). Then for all πψσ
1701
+ t
1702
+ ∈ ∆(Xt×St)N, si
1703
+ t ∈
1704
+
1705
+ Springer Nature 2021 LATEX template
1706
+ Dynamic Games with Asymmetric Information and Hidden Actions
1707
+ 21
1708
+ Sis
1709
+ Eˆσi
1710
+ t,ˆσ−i
1711
+ t
1712
+ ,ψσ
1713
+ [Ui
1714
+ Gt(Vt+1,πψσ
1715
+ t
1716
+ ) | si
1717
+ t]
1718
+ = max
1719
+ ˜σi
1720
+ t∈Λi
1721
+ t
1722
+ E˜σi
1723
+ t,ˆσ−i
1724
+ t
1725
+ ,ψσ
1726
+ [ui
1727
+ t(Xt, At) + V i
1728
+ t+1(ψσ
1729
+ t+1(πψσ
1730
+ t
1731
+ , Zt+1), Si
1732
+ t+1) | si
1733
+ t].
1734
+ (51)
1735
+ Equation (51) holds for all t ∈ T with V i
1736
+ T +1(·, ·) = 0 and for all i ∈ N. When ˆσt = σt
1737
+ for all t ∈ T , Equation (51) gives, for all πψσ
1738
+ t
1739
+ ∈ ∆(Xt × St)N, si
1740
+ t ∈ Sis,
1741
+ V i
1742
+ t (πψσ
1743
+ t
1744
+ , si
1745
+ t) = Eσi
1746
+ t,σ−i
1747
+ t
1748
+ ,ψσ
1749
+ [Ui
1750
+ Gt(Vt+1,πψσ
1751
+ t
1752
+ ) | si
1753
+ t]
1754
+ = max
1755
+ ˜σi
1756
+ t∈Λi
1757
+ t
1758
+ E˜σi
1759
+ t,σ−i
1760
+ t
1761
+ ,ψσ
1762
+ [ui
1763
+ t(Xt, At) + V i
1764
+ t+1(ψσ
1765
+ t+1(πψσ
1766
+ t
1767
+ , Zt+1), Si
1768
+ t+1) | si
1769
+ t]
1770
+ (52)
1771
+ for all i ∈ N.
1772
+ By induction, (52), and the fact that the update rule ψσ is consistent with σ we
1773
+ have, for all i ∈ N and t ∈ T ,
1774
+ E˜σi
1775
+ t:T ,σ−i
1776
+ t:T ,ψσ
1777
+ [
1778
+ T
1779
+
1780
+ τ=t
1781
+ ui
1782
+ τ (Xτ , Aτ) | si
1783
+ τ] ≤ Eσi
1784
+ t:T ,σ−i
1785
+ t:T ,ψσ
1786
+ [
1787
+ T
1788
+
1789
+ τ=t
1790
+ ui
1791
+ τ (Xτ , Aτ) | si
1792
+ τ]
1793
+ (53)
1794
+ Then (53) at time t = 1 gives
1795
+ E˜σi,σ−i,ψσ
1796
+ {Ui(X1:T , A1:T )} ≤ Eσ,ψσ
1797
+ {Ui(X1:T , A1:T )}
1798
+ (54)
1799
+ for all ˜σi ∈ Λi for all i ∈ N. Therefore, the strategy profile σ is a SIB-BNE of the
1800
+ original dynamic game (sf. Definition 6).
1801
+
1802
+ Remark 5. Note that even when the stage-game Gt(Vt+1, πψσ
1803
+ t
1804
+ ) has a BNE
1805
+ ˆσt, it is possible that ˆσt ̸= σt. Thus, the existence of BNE for every stage-
1806
+ game Gt(Vt+1, πψσ
1807
+ t
1808
+ ) is not sufficient to establish the existence of BNE for the
1809
+ original dynamic game.
1810
+ Remark 6. In the model of Tang et al (2022) when each team consists of
1811
+ one agent, a SIB BNE coincides with a SPCIB BNE introduced in Tang et al
1812
+ (2022) with an appropriate mapping of the information state as discussed in
1813
+ Remark 4.
1814
+ Remark 7. There may not be a solution for the set of value functions in the
1815
+ sequential decomposition equations described by (47)-(50) for all i ∈ N and
1816
+ for all t ∈ T .
1817
+ Remark 8. In Definition 4, (21) could be defined differently, and different
1818
+ (21) would lead to different choices of ψ. And for any choice of (21), the claim
1819
+ of Theorem 2 will still hold.
1820
+ Remark 9. The value functions of the sequential decomposition equations
1821
+ defined by Theorem 2 (Eqs. (47)-(50) for all i ∈ N, t ∈ T ) may not be
1822
+ continuous in the CIB belief Πψσ
1823
+ t .
1824
+
1825
+ Springer Nature 2021 LATEX template
1826
+ 22
1827
+ Dynamic Games with Asymmetric Information and Hidden Actions
1828
+ 6 An illustrative example (Step 4)
1829
+ In Section 5 we argued (cf. Remark 7) that the sequential decomposition
1830
+ equations defined by (47)-(50) for all i ∈ N, t ∈ T may not have a solution,
1831
+ and that the value functions defined by (47)-(50) may not be continuous in
1832
+ the CIB belief Πψσ
1833
+ t
1834
+ (cf. Remark 9). In this section we present an example that
1835
+ illustrates/highlights the above remarks. In the example, a two-stage stochas-
1836
+ tic dynamic game, the agents’ utilities depend on a parameter c. We show
1837
+ that: (i) the value functions of the corresponding sequential decomposition
1838
+ equations are not continuous in the CIB belief Πψσ
1839
+ t ; (ii) for certain values of c
1840
+ a SIB-BNE exists.
1841
+ 6.1 Model
1842
+ We consider the following two-stage stochastic dynamic game. There are two
1843
+ players/agents, Alice and Bob. At stage one, t = 1, the system’s state X1
1844
+ is distributed on {−1, 1} with µ0(−1) = P(X1 = −1) = 0.5 and µ1(1) =
1845
+ P(X1 = 1) = 0.5. Alice observes perfectly X1, i.e., Y Alice
1846
+ 1
1847
+ = X1, and takes
1848
+ action AAlice
1849
+ 1
1850
+ ∈ {−1, 1}; AAlice
1851
+ 1
1852
+ is not observable by Bob and Y Bob
1853
+ 1
1854
+ = ∅. Bob
1855
+ does not act at t = 1. At stage 2, t = 2, the system state is X2 = X1AAlice
1856
+ 1
1857
+ .
1858
+ Alice and Bob have a common observation Z2 = X2AAlice
1859
+ 1
1860
+ W1 = X1W1, where
1861
+ W1 ∈ {−1, 1} and P(Z = i | X1 = i) = 1 − p = 0.8, i ∈ {−1, 1}, and there are
1862
+ no private observations, i.e., Y Alice
1863
+ 2
1864
+ = Y Bob
1865
+ 2
1866
+ = ∅. Here p = 0.2 = P(W1 = −1).
1867
+ Bob acts at t = 2. Alice does not act at t = 2. Bob’s action ABob
1868
+ 2
1869
+ ∈ {−1, 1}.
1870
+ Alice’s payoffs at t = 1 and t = 2 are
1871
+ uAlice
1872
+ 1
1873
+ (X1, A1) =
1874
+
1875
+ c
1876
+ if AAlice
1877
+ 1
1878
+ = 1
1879
+ 0 if AAlice
1880
+ 1
1881
+ = −1
1882
+ (55)
1883
+ and
1884
+ uAlice
1885
+ 2
1886
+ (X2, A2) =
1887
+
1888
+
1889
+
1890
+ 2 if X2 = 1, ABob
1891
+ 2
1892
+ = 1
1893
+ 1 if X2 = −1, ABob
1894
+ 2
1895
+ = −1
1896
+ 0 otherwise
1897
+ (56)
1898
+ respectively. Bob’s payoffs are uBob
1899
+ t
1900
+ (Xt, At) = −uAlice
1901
+ t
1902
+ (Xt, At), t = 1, 2.
1903
+ The game’s information structure is
1904
+ HAlice
1905
+ 1
1906
+ ={X1}
1907
+ (57)
1908
+ HAlice
1909
+ 2
1910
+ ={X1, AAlice
1911
+ 1
1912
+ , X2, Z2}
1913
+ (58)
1914
+ HBob
1915
+ 1
1916
+ =∅
1917
+ (59)
1918
+ HBob
1919
+ 2
1920
+ ={Z2}
1921
+ (60)
1922
+ where HAlice
1923
+ t
1924
+ , HBob
1925
+ t
1926
+ , t = 1, 2, describe the information available to Alice and
1927
+ Bob, respectively, at stages 1 and 2.
1928
+
1929
+ Springer Nature 2021 LATEX template
1930
+ Dynamic Games with Asymmetric Information and Hidden Actions
1931
+ 23
1932
+ This example has the same dynamics and utility functions as Example 3
1933
+ in Tang et al (2022), but Bob doesn’t observe Alice’s action as in (Tang et al,
1934
+ 2022, Example 3).
1935
+ 6.2 Sequential decomposition
1936
+ Since Alice perfectly observes the state at both times, i.e., Y Alice
1937
+ 1
1938
+ = X1 and
1939
+ Y Alice
1940
+ 2
1941
+ = X2, and Bob doesn’t have private information, SAlice
1942
+ 1
1943
+ = X1, SBob
1944
+ 1
1945
+ = ∅
1946
+ are sufficient private information for Alice and Bob at stage t = 1, respectively,
1947
+ and SAlice
1948
+ 2
1949
+ = X2, SBob
1950
+ 2
1951
+ = ∅ are sufficient private information for Alice and
1952
+ Bob, respectively, at stage t = 2 according to Definition 1.
1953
+ Suppose σ = (σ1, σ2) = (σAlice
1954
+ 1
1955
+ , σBob
1956
+ 2
1957
+ ) is a SIB strategy and ψσ is the
1958
+ corresponding update rule. Here σ is an equilibrium strategy candidate which
1959
+ serves as the strategy prediction for Alice and Bob. Note that Πψσ,Alice
1960
+ 1
1961
+ (x1) =
1962
+ µ0(x1) and Πψσ,Bob
1963
+ 1
1964
+ (x1) = µ0(x1) for all x1 ∈ X1.
1965
+ To get a BNE using the sequential decomposition of Theorem 2, we first
1966
+ consider the stage-game G2(0, πψσ
1967
+ 2 ) at time 2. Since Bob is the only agent who
1968
+ acts at time 2 and SBob
1969
+ 2
1970
+ = ∅, any BNE σ2 of G2(0, πψσ
1971
+ 2 ) must satisfy
1972
+ ˆσBob
1973
+ 2
1974
+ = arg max
1975
+ ˜σBob
1976
+ 2
1977
+ E˜σBob
1978
+ 2
1979
+ ,ψσ[uBob
1980
+ 2
1981
+ (X2, A2)]
1982
+ = arg max
1983
+ ˜σBob
1984
+ 2
1985
+
1986
+ − 2 P˜σBob
1987
+ 2
1988
+ ,ψσ
1989
+ (X2 = ABob
1990
+ 2
1991
+ = 1) − P˜σBob
1992
+ 2
1993
+ ,ψσ(X2 = ABob
1994
+ 2
1995
+ = −1)
1996
+
1997
+ = arg max
1998
+ ˜σBob
1999
+ 2
2000
+
2001
+ − 2πψσ,Bob
2002
+ 2
2003
+ (1)˜σψσ,Bob
2004
+ 2
2005
+ (1 | πψσ
2006
+ 2 )
2007
+ − (1 − πψσ,Bob
2008
+ 2
2009
+ (1))(1 − ˜σψσ,Bob
2010
+ 2
2011
+ (1 | πψσ
2012
+ 2 ))
2013
+
2014
+ (61)
2015
+ From (61) we conclude that one of the equilibrium SIB strategies is given by
2016
+ σBob
2017
+ 2
2018
+ (πψσ
2019
+ 2 ) = 1, if πψσ,Bob
2020
+ 2
2021
+ (1) ≤ 1/3,
2022
+ σBob
2023
+ 2
2024
+ (πψσ
2025
+ 2 ) = 0, if πψσ,Bob
2026
+ 2
2027
+ (1) > 1/3,
2028
+ or equivalently
2029
+ σBob
2030
+ 2
2031
+ (πψσ
2032
+ 2 ) = 1(πψσ,Bob
2033
+ 2
2034
+ (1) ≤ 1/3)
2035
+ (62)
2036
+ Note that σBob
2037
+ 2
2038
+ (πψσ
2039
+ 2 ) can take any value in [0, 1] if πψσ,Bob
2040
+ 2
2041
+ (1) = 1/3 and σ2 is
2042
+ still a BNE of the stage-game.
2043
+ Alice’s sufficient private information at time 2 is SAlice
2044
+ 2
2045
+ = X2. With the
2046
+ stage-game equilibrium SIB strategy σBob
2047
+ 2
2048
+ (π2) given by (62), the value function
2049
+ for Alice at t = 2 is then given, according to (48), by
2050
+ V Alice
2051
+ 2
2052
+ (πψσ
2053
+ 2 , x2) = Eσ2,ψσ[uAlice
2054
+ 2
2055
+ (X2, A2) | x2]
2056
+
2057
+ Springer Nature 2021 LATEX template
2058
+ 24
2059
+ Dynamic Games with Asymmetric Information and Hidden Actions
2060
+ =
2061
+
2062
+ 21(πψσ,Bob
2063
+ 2
2064
+ (1) ≤ 1/3)
2065
+ if x2 = 1
2066
+ 1 − 1(πψσ,Bob
2067
+ 2
2068
+ (1) ≤ 1/3) if x2 = −1
2069
+ (63)
2070
+ Given the above value functions at time t = 2, we now consider the stage-
2071
+ game G1(V2, πψσ
2072
+ 1 ) at time t = 1. The utility for the stage-game for Alice is
2073
+ given as follows.
2074
+ U Alice
2075
+ G1(V2,πψσ
2076
+ 1
2077
+ ) = uAlice
2078
+ 1
2079
+ (X1, A1) + V Alice
2080
+ 2
2081
+ (ψσ
2082
+ 2 (π1, Z), X2)
2083
+ (64)
2084
+ If Alice uses the SIB strategy ˜σAlice
2085
+ 1
2086
+ , the expected utility of the stage-game
2087
+ can be calculated for X1 = −1 and X1 = 1, according to (46), by
2088
+ E˜σAlice
2089
+ 1
2090
+ ,ψσ[U Alice
2091
+ G1(V2,πψσ
2092
+ 1
2093
+ ) | X1 = −1]
2094
+ =c˜σAlice
2095
+ 1
2096
+ (1 | −1) + E˜σAlice
2097
+ 1
2098
+ ,ψσ[V A
2099
+ 2 (ψσ
2100
+ 2 (πψσ
2101
+ 1 , X1W1), X1AAlice
2102
+ 1
2103
+ ) | X1 = −1]
2104
+ =(1 + c)(1 − ˜α1) + (3˜α1 − 1)((1 − p)1(q−1 ≤ 1/3) + p1(q1 ≤ 1/3))
2105
+ =:rA
2106
+ −1(˜α1, q)
2107
+ (65)
2108
+ E˜σAlice
2109
+ 1
2110
+ ,ψσ[U Alice
2111
+ G1(V2,πψσ
2112
+ 1
2113
+ ) | X1 = 1]
2114
+ =c˜σAlice
2115
+ 1
2116
+ (1 | 1) + E˜σAlice
2117
+ 1
2118
+ ,ψσ[V A
2119
+ 2 (ψσ
2120
+ 2 (πψσ
2121
+ 1 , X1W1), X1AAlice
2122
+ 1
2123
+ ) | X1 = 1]
2124
+ =1 + (c − 1)˜α2 + (3˜α2 − 1)((1 − p)1(q1 ≤ 1/3) + p1(q−1 ≤ 1/3))
2125
+ =:rA
2126
+ 1 (˜α2, q)
2127
+ (66)
2128
+ where q = (q−1, q1), q−1 = ψσ,Bob
2129
+ 2
2130
+ (πψσ
2131
+ 1 , −1)(1) and q1 = ψσ,Bob
2132
+ 2
2133
+ (πψσ
2134
+ 1 , 1)(1) are
2135
+ the CIB beliefs πψσ,Bob
2136
+ 2
2137
+ (1) of {X2 = 1} when Z = −1 and Z = 1, respectively,
2138
+ and ˜α = (˜α1, ˜α2), ˜α1 = ˜σAlice
2139
+ 1
2140
+ (−1 | −1), ˜α2 = ˜σAlice
2141
+ 1
2142
+ (1 | 1) represents Alice’s
2143
+ SIB strategy ˜σAlice
2144
+ 1
2145
+ .
2146
+ Note that from Bayes’ rule in Definition 4, under the SIB strategy σAlice
2147
+ 1
2148
+ ,
2149
+ represented by α1 = σAlice
2150
+ 1
2151
+ (−1 | −1) and α2 = σAlice
2152
+ 1
2153
+ (1 | 1), we have
2154
+ q−1 = ψψσ,Bob
2155
+ 2
2156
+ (πψσ
2157
+ 1 , −1)(1) = Pα(X2 = 1, Z = −1)
2158
+ Pα(Z = −1)
2159
+ = α2p + α1(1 − p)
2160
+ (67)
2161
+ q1 = ψψσ,Bob
2162
+ 2
2163
+ (πψσ
2164
+ 1 , 1)(1) = Pα(X2 = 1, Z = 1)
2165
+ Pα(Z = 1)
2166
+ = α2(1 − p) + α1p
2167
+ (68)
2168
+ Therefore, a SIB strategy ˆσAlice
2169
+ 1
2170
+ , represented by ˆα1 = ˆσAlice
2171
+ 1
2172
+ (−1 | −1) and
2173
+ ˆα2 = ˆσAlice
2174
+ 1
2175
+ (1 | 1), is a BNE of the stage-game G1(V2, πψσ
2176
+ 1 ) at time t = 1 if
2177
+ ˆα1 ∈ arg max
2178
+ ˜α1
2179
+ rA
2180
+ −1(˜α1, (α2p + α1(1 − p), α2(1 − p) + α1p))
2181
+ (69)
2182
+ ˆα2 ∈ arg max
2183
+ ˜α2
2184
+ rA
2185
+ 1 (˜α2, (α2p + α1(1 − p), α2(1 − p) + α1p))
2186
+ (70)
2187
+
2188
+ Springer Nature 2021 LATEX template
2189
+ Dynamic Games with Asymmetric Information and Hidden Actions
2190
+ 25
2191
+ Consequently, the SIB strategy σAlice
2192
+ 1
2193
+ , represented by α1 = σAlice
2194
+ 1
2195
+ (−1 | −1)
2196
+ and α2 = σAlice
2197
+ 1
2198
+ (1 | 1) will satisfy the sequential decomposition equations
2199
+ (49)-(50) if
2200
+ α1 ∈ arg max
2201
+ ˜α1
2202
+ rA
2203
+ −1(˜α1, (α2p + α1(1 − p), α2(1 − p) + α1p))
2204
+ (71)
2205
+ α2 ∈ arg max
2206
+ ˜α2
2207
+ rA
2208
+ 1 (˜α2, (α2p + α1(1 − p), α2(1 − p) + α1p))
2209
+ (72)
2210
+ Remark 10. Note that the functions rA
2211
+ −1(˜α1, q) and rA
2212
+ 1 (˜α2, q) are not contin-
2213
+ uous in q. Thus existence of equilibria cannot be established by the standard
2214
+ method relying on the continuity of the utility functions, and there may not no
2215
+ equilibria in the general case.
2216
+ 6.3 Existence of SIB-BNE under conditions on the
2217
+ instantaneous utility.
2218
+ The stage-game G1(V2, πψσ
2219
+ 1 ) is a normal-form game with a fixed σ1. According
2220
+ to Remark 5, a BNE ˆσ of G1(V2, πψσ
2221
+ 1 ) could be different from σ1 and the
2222
+ existence of a regular BNE of G1(V2, πψσ
2223
+ 1 ) is not sufficient to satisfy (50) at
2224
+ time t = 1. In order to apply equilibrium existence results for normal-form
2225
+ games to the sequential decomposition at time t = 1, we introduce an agent 0
2226
+ who picks the q-belief q = (q−1, q1) so that (50) is satisfied.
2227
+ Formally, we construct an augmented stage-game ˆG1 between Alice and
2228
+ agent 0. Alice chooses ˜α = (˜α1, ˜α2) and agent 0 chooses ˜q = (˜q−1, ˜q1). Alice’s
2229
+ utility is
2230
+ rA
2231
+ 1 (˜α, ˜q) =0.5rA
2232
+ −1(˜α1, ˜q) + 0.5rA
2233
+ 1 (˜α2, ˜q)
2234
+ =0.5c(1 − ˜α1 + ˜α2) + 0.5(2 − ˜α1 − ˜α2)
2235
+ + 0.5(3(˜α2p + ˜α1(1 − p)) − 1)1(˜q−1 ≤ 1/3)
2236
+ + 0.5(3(˜α2(1 − p) + ˜α1p) − 1)1(˜q1 ≤ 1/3).
2237
+ (73)
2238
+ Agent 0’s utility is
2239
+ r0
2240
+ 1(˜α, ˜q) = −(˜q−1 − ˜α2p − ˜α1(1 − p))2 − (˜q1 − ˜α2(1 − p) − ˜α1p)2.
2241
+ (74)
2242
+ Both Alice and agent 0 are utility maximizers. The game ˆG1 with utilities
2243
+ (74)-(73) is a normal-form game with strategies ˜α = (˜α1, ˜α2) ˜q = (˜q−1, ˜q1).
2244
+ Since the utility (74) of agent 0 is a quadratic function, any best response by
2245
+ agent 0 must satisfy ˜q−1 = ˜α2p + ˜α1(1 − p), ˜q1 = ˜α2(1 − p) + ˜α1p.
2246
+ Note that in the augmented stage-game ˆG1, the utility function rA
2247
+ 1 (˜α, ˜q)
2248
+ is not continuous in ˜q. To show the existence of a Nash equilibrium for ˆG1,
2249
+ we proceed to apply existence results for games with discontinuous utilities in
2250
+ Barelli and Meneghel (2013).
2251
+
2252
+ Springer Nature 2021 LATEX template
2253
+ 26
2254
+ Dynamic Games with Asymmetric Information and Hidden Actions
2255
+ Specifically, Proposition 2.4 of Barelli and Meneghel (2013) guarantees the
2256
+ existence of a Nash equilibrium for games satisfying the generalized better
2257
+ reply secure property. From Definition 2.3 in Barelli and Meneghel (2013), the
2258
+ stage game is generalized better reply secure if for any (¯α, ¯q) not an equilibrium,
2259
+ at least one of the followings is true
2260
+ • We can find an ǫ > 0 and a closed correspondence φ0(˜α, ˜q) such that
2261
+ r0
2262
+ 1(˜α, φ0(˜α, ˜q)) ≥ r0
2263
+ 1(¯α, ¯q) + ǫ
2264
+ (75)
2265
+ for all ˜α1 ∈ (¯α1 − ǫ, ¯α1 + ǫ), ˜α2 ∈ (¯α2 − ǫ, ¯α2 + ǫ), ˜q−1 ∈ (¯q−1 − ǫ, ¯q−1 + ǫ),
2266
+ ˜q1 ∈ (¯q1 − ǫ, ¯q1 + ǫ)
2267
+ • We can find an ǫ > 0 and a closed correspondence φA(˜α, ˜q) such that
2268
+ rA
2269
+ 1 (φA(˜α, ˜q), ˜q) ≥ rA
2270
+ 1 (¯α, ¯q) + ǫ
2271
+ (76)
2272
+ for all ˜α1 ∈ (¯α1 − ǫ, ¯α2 + ǫ), ˜α2 ∈ (¯α2 − ǫ, ¯α2 + ǫ), ˜q−1 ∈ (¯q−1 − ǫ, ¯q−1 + ǫ),
2273
+ ˜q1 ∈ (¯q1 − ǫ, ¯q1 + ǫ)
2274
+ In Appendix .2, we show that when c > 24 the augmented stage-game
2275
+ ˆG1 is generalized better reply secure. Thus, there exists a Nash equilibrium
2276
+ of the augmented state-game ˆG1 according to (Barelli and Meneghel, 2013,
2277
+ Proposition 2.4).
2278
+ Consider any Nash equilibrium (α, q) of ˆG1. Since q is a best response to
2279
+ α for agent 0, from agent 0’s utility (74) we have
2280
+ q−1 = α2p + α1(1 − p)
2281
+ (77)
2282
+ q1 = α2(1 − p) + α1p
2283
+ (78)
2284
+ Furthermore, since α is a best response to q for Alice in ˆG1,
2285
+ α ∈ arg max
2286
+ ˜α
2287
+
2288
+ 0.5rA
2289
+ −1(˜α1, q) + 0.5rA
2290
+ 1 (˜α2, q)
2291
+
2292
+ = arg max
2293
+ ˜α
2294
+
2295
+ 0.5rA
2296
+ −1(˜α1, (α2p + α1(1 − p), α2(1 − p) + α1p))
2297
+ + 0.5rA
2298
+ 1 (˜α2, (α2p + α1(1 − p), α2(1 − p) + α1p))
2299
+
2300
+ =
2301
+
2302
+ arg max
2303
+ ˜α1
2304
+ rA
2305
+ −1(˜α1, (α2p + α1(1 − p), α2(1 − p) + α1p)),
2306
+ arg max
2307
+ ˜α2
2308
+ rA
2309
+ 1 (˜α2, (α2p + α1(1 − p), α2(1 − p) + α1p))
2310
+
2311
+ (79)
2312
+ Therefore, (71)-(72) hold for α, and consequently the sequential decomposi-
2313
+ tion requirement (49)-(50) is satisfied at t = 1 by the SIB strategy σAlice
2314
+ 1
2315
+ represented by α, and we establish the existence of a SIB equilibrium based
2316
+ on Theorem 2.
2317
+
2318
+ Springer Nature 2021 LATEX template
2319
+ Dynamic Games with Asymmetric Information and Hidden Actions
2320
+ 27
2321
+ 7 The case with no common observations
2322
+ We consider the model of Section 2 but we assume that the agents have no
2323
+ common observations, that is,
2324
+ Zt = ∅
2325
+ ∀t ∈ T .
2326
+ (80)
2327
+ The system’s dynamics, the agents’ private observations, the functional form
2328
+ of the agents’ strategies, their utilities, and the equilibrium concept (BNE)
2329
+ remain the same as in Section 2.
2330
+ Even though the agents have no common observations in this special case,
2331
+ we can still define SIB strategies by Definition 3, and construct the consistent
2332
+ CIB belief system according to Definition 4 with Zt = ∅ ∀t ∈ T .
2333
+ Since there is no common observations, for any realization we always have
2334
+
2335
+ ˆxt+1,ˆst+1
2336
+ F i
2337
+ t (ˆxt+1, ˆst+1, zt+1)(πψσ
2338
+ t
2339
+ ; σ−i
2340
+ t )
2341
+ =
2342
+
2343
+ ˆxt+1,ˆst+1
2344
+ F i
2345
+ t (ˆxt+1, ˆst+1)(πψσ
2346
+ t
2347
+ ; σ−i
2348
+ t ) = 1 > 0
2349
+ (81)
2350
+ Therefore, case (ii) in Definition 4 would never happen, and (20) can be
2351
+ simplified to
2352
+ πψσ,i
2353
+ t+1 (xt+1, st+1)
2354
+ =
2355
+ F i
2356
+ t (xt+1, st+1)(πψσ
2357
+ t
2358
+ ; σ−i
2359
+ t )
2360
+
2361
+ ˆxt+1,ˆst+1 F i
2362
+ t (ˆxt+1, ˆst+1)(πψσ
2363
+ t
2364
+ ; σ−i
2365
+ t )
2366
+ =F i
2367
+ t (xt+1, st+1)(πψσ
2368
+ t
2369
+ ; σ−i
2370
+ t )
2371
+ =
2372
+
2373
+ yt+1,xt,st,at
2374
+
2375
+ P{yt+1, xt+1 | xt, at}
2376
+ ��
2377
+ j
2378
+ 1{sj
2379
+ t+1 = φj
2380
+ t+1(sj
2381
+ t, yj
2382
+ t+1, aj
2383
+ t)}
2384
+
2385
+
2386
+  1
2387
+ |Ai
2388
+ t|
2389
+
2390
+ j̸=i
2391
+ σj
2392
+ t (aj
2393
+ t)(πψ
2394
+ t , sj
2395
+ t)
2396
+
2397
+  πψ,i
2398
+ t
2399
+ (xt, st)
2400
+
2401
+ .
2402
+ (82)
2403
+ Based on (82) we can write
2404
+ Πψσ,i
2405
+ t+1 = ψσ,i
2406
+ t+1(Πψσ
2407
+ t )
2408
+ ∀i ∈ N,
2409
+ (83)
2410
+ Πψσ
2411
+ t+1 = ψσ
2412
+ t+1(Πψσ
2413
+ t ).
2414
+ (84)
2415
+ In other words, given a SIB strategy σ, the update rule ψσ are deterministic
2416
+ functions given by (84), and the corresponding consistent CIB belief system
2417
+ Πψσ
2418
+ t , t ∈ T , evolves in a deterministic manner. Furthermore, since case (ii)
2419
+ in Definition 4 never happens without common observations, the update rule
2420
+
2421
+ Springer Nature 2021 LATEX template
2422
+ 28
2423
+ Dynamic Games with Asymmetric Information and Hidden Actions
2424
+ ψσ,i
2425
+ t+1 given by (82) becomes exactly the Bayes rule. As a result, the CIB belief
2426
+ Πψσ,i
2427
+ t
2428
+ becomes a regular PMF given by
2429
+ Πψσ,i
2430
+ t
2431
+ (xt, st) = P˜gi,σ−i(xt, st)
2432
+ ∀i ∈ N
2433
+ (85)
2434
+ where ˜gi denotes the uniform strategy (i.e., the strategy that chooses every
2435
+ action ai
2436
+ t ∈ Ai
2437
+ t with equal probability for all t ∈ T ).
2438
+ Remark 11. If the N agents have identical utilities, i.e. we have a dynamic
2439
+ team problem, then Πψσ
2440
+ t , t ∈ T is similar to the common knowledge that
2441
+ appears in Witsenhausen (1973) where a dynamic team is analyzed. The com-
2442
+ mon knowledge in Witsenhausen (1973) is a sequence (over time) of PMFs on
2443
+ the system’s history Ht, t ∈ T . These PMFs evolve in a deterministic manner,
2444
+ similar to (82) for Πψσ
2445
+ t , t ∈ T , in the model of this section.
2446
+ For this special case with no common observations, Theorem 2 becomes
2447
+ Corollary 1. Consider a SIB strategy profile σ = {σt, t ∈ T } and the corre-
2448
+ sponding update rule ψσ = {ψσ
2449
+ t , t ∈ T } defined by (83)-(84) for the model of
2450
+ this section. Define
2451
+ V i
2452
+ T +1(·, ·) = 0 for all i
2453
+ (86)
2454
+ V i
2455
+ t (πψσ
2456
+ t , si
2457
+ t) = Eσt,ψσ[U i
2458
+ Gt(Vt+1,πψσ
2459
+ t ) | si
2460
+ t]
2461
+ (87)
2462
+ where U i
2463
+ Gt(Vt+1,πψσ
2464
+ t
2465
+ )
2466
+ =
2467
+ ui
2468
+ t(Xt, At) + V i
2469
+ t+1(ψσ
2470
+ t+1(πψσ
2471
+ t
2472
+ ), Si
2473
+ t+1), and in the
2474
+ conditional expectation Eσt,ψσ[·], the distribution of (Xt, St) conditioned
2475
+ on Si
2476
+ t is given by πψσ,i
2477
+ t
2478
+ (xt, s−i
2479
+ t ), Ai
2480
+ t, i
2481
+
2482
+ N, are generated by σi
2483
+ t(ai
2484
+ t
2485
+ |
2486
+ si
2487
+ t, πψσ
2488
+ t
2489
+ ), Si
2490
+ t+1 conditioned on (Xt, St, At) follows the conditional probability
2491
+
2492
+ xt+1,s−i
2493
+ t+1 P(xt+1, st+1 | xt, st, at) given by
2494
+ P(xt+1, st+1 | xt, st, at)
2495
+ =
2496
+
2497
+ yt+1
2498
+ P{xt+1 | xt, at}P{yt+1 | xt+1, at}
2499
+ ��
2500
+ j
2501
+ 1{sj
2502
+ t+1 = φj
2503
+ t+1(sj
2504
+ t, yj
2505
+ t+1, aj
2506
+ t)}
2507
+
2508
+ .
2509
+ (88)
2510
+ If for all t ∈ T , there is a SIB strategy profile ˆσt such that ˆσt is a BNE of the
2511
+ stage-game Gt(Vt+1, πψσ
2512
+ t ), that is,
2513
+ Eˆσi
2514
+ t,ˆσ−i
2515
+ t
2516
+ ,ψσ[U i
2517
+ Gt(Vt+1,πψσ
2518
+ t
2519
+ ) | si
2520
+ t] = max
2521
+ ˜σi
2522
+ t∈Λi
2523
+ t
2524
+ E˜σi
2525
+ t,ˆσ−i
2526
+ t
2527
+ ,ψσ[U i
2528
+ Gt(Vt+1,πψσ
2529
+ t
2530
+ ) | si
2531
+ t]
2532
+ (89)
2533
+
2534
+ Springer Nature 2021 LATEX template
2535
+ Dynamic Games with Asymmetric Information and Hidden Actions
2536
+ 29
2537
+ for all i ��� N, and
2538
+ ˆσt = σt,
2539
+ (90)
2540
+ then the SIB strategy profile σ is a SIB-BNE of the dynamic game without
2541
+ common observations defined in this section.
2542
+ Remark 12. The SIB-BNE strategy profiles {σt, t ∈ T } determined by sequen-
2543
+ tial decomposition in Corollary 1, along with the beliefs {Πψσ
2544
+ t , t ∈ T } are also
2545
+ Perfect Bayesian Equilibria (PBE) Fudenberg and Tirole (1991). This is true
2546
+ because {σt, t ∈ T } satisfy sequential rationality (Eq. (89)) and consistency
2547
+ holds because the beliefs {Πψσ
2548
+ t , t ∈ T } are always updated by Bayes rule.
2549
+ 8 Conclusion
2550
+ We considered stochastic dynamic games where the underlying system is
2551
+ dynamic, the strategic agents’ actions are hidden (not observable) and their
2552
+ information is asymmetric. We presented an approach for the computation of
2553
+ BNE strategy profiles that are based on a compressed version of the agents’
2554
+ information and can be determined sequentially in time moving backwards, if
2555
+ each step of this backward procedure has a solution. The approach highlights:
2556
+ (i) the importance of common information/common knowledge in identifying
2557
+ BNE strategy profiles that can be sequentially computed; (ii) the difference
2558
+ between common information that is sufficient for decision-making purposes
2559
+ in games and common information that is sufficient for decision-making pur-
2560
+ poses in teams. The difference is due to the fact that agents have an incentive
2561
+ to deviate from their predicted strategies in games whereas they don’t have
2562
+ such an incentive in teams. As a consqence of this incentive, at each time
2563
+ instant each agent has his own view/belief of the game’s status based on the
2564
+ common information, but all these different views/beliefs are common knowl-
2565
+ edge among all agents. As a result the CIB belief system is described by the
2566
+ sequence Πψ
2567
+ 1:T specified by Definition 2.
2568
+ Our investigation focused on determining SIB-BNE strategy profiles for
2569
+ the games under consideration. We note that the SIB-BNE strategy profiles
2570
+ determined by our methodology are also Perfect Bayesian Equilibrium (PBE)
2571
+ strategy profiles when the agents have no common observations (i.e., for the
2572
+ model of Section 7), but this is not true when the agents have common obser-
2573
+ vations (the general model of Section 2). Determining PBE strategy profiles for
2574
+ the general model of Section 2 is an interesting problem worthy of investigation.
2575
+ .1 Sufficient Information
2576
+ We compare conditions (i)-(iii) of Definition 1 to the conditions of Definition
2577
+ 2 in Tavafoghi et al (2022); for ease of readability, we include the definition
2578
+ from Tavafoghi et al (2022) below.
2579
+
2580
+ Springer Nature 2021 LATEX template
2581
+ 30
2582
+ Dynamic Games with Asymmetric Information and Hidden Actions
2583
+ Definition 7 (Sufficient private information Tavafoghi et al (2022)). We say
2584
+ Si
2585
+ t = ζi
2586
+ t(P i
2587
+ t , Ct; g1:t−1), i ∈ N, t ∈ T , is sufficient private information for the
2588
+ agents if,
2589
+ (i) it can be updated recursively as
2590
+ Si
2591
+ t = φi
2592
+ t(Si
2593
+ t−1, Hi
2594
+ t\Hi
2595
+ t−1; g1:t−1) for t ∈ T \{1},
2596
+ (91)
2597
+ (ii) for any strategy profile g and for all realizations {ct, pt, pt+1, zt+1, at} ∈
2598
+ Ct × Pt × Pt+1 × Zt+1 of positive probability,
2599
+ Pg1:t {st+1,zt+1 | pt,ct,at}=Pg1:t {st+1,zt+1 | st,ct,at},
2600
+ (92)
2601
+ where s1:N
2602
+ τ
2603
+ = ζ1:N
2604
+ τ
2605
+ (p1:N
2606
+ τ
2607
+ , cτ; g1:τ−1) for τ ∈ T ;
2608
+ (iii) for every strategy profile ˜g of the form ˜g:={˜gi
2609
+ t : Si
2610
+ t × Ct → ∆(Ai
2611
+ t), i∈N,t∈
2612
+ T } and at∈At, t∈T ;
2613
+ E˜g1:t−1�
2614
+ ui
2615
+ t(Xt,At) | ct,pi
2616
+ t,at
2617
+
2618
+ =E˜g1:t−1�
2619
+ ui
2620
+ t(Xt,At) | ct,si
2621
+ t,at
2622
+
2623
+ ,
2624
+ (93)
2625
+ for all realizations {ct,pi
2626
+ t} ∈ Ct × Pi
2627
+ t of positive probability where s1:N
2628
+ τ
2629
+ =
2630
+ ζ1:N
2631
+ τ
2632
+ (p1:N
2633
+ τ
2634
+ ,cτ; ˜g1:τ−1) for τ ∈ T ;
2635
+ (iv) given an arbitrary strategy profile ˜g of the form ˜g := {˜gi
2636
+ t : Si
2637
+ t × Ct →
2638
+ ∆(Ai
2639
+ t), i∈N, t∈T }, i∈N, and t∈T ,
2640
+ P˜g1:t−1�
2641
+ s−i
2642
+ t
2643
+ | pi
2644
+ t,ct
2645
+
2646
+ =P˜g1:t−1�
2647
+ s−i
2648
+ t
2649
+ | si
2650
+ t,ct
2651
+
2652
+ ,
2653
+ (94)
2654
+ for all realizations {ct,pi
2655
+ t} ∈ Ct ×Pi
2656
+ t of positive probability where s1:N
2657
+ τ
2658
+ =
2659
+ ζ1:N
2660
+ τ
2661
+ (p1:N
2662
+ τ
2663
+ ,cτ; ˜g1:τ−1) for τ ∈ T .
2664
+ Condition (i) of Definition 1 appears in the definition of Si
2665
+ t in Definition 7,
2666
+ and condition (ii) of Definition 1 on recursive update is the same as condition
2667
+ (i) in Definition 7. Condition (iii) of Definition 1 directly leads to (iii) and (iv)
2668
+ of Definition 7; the utility ui
2669
+ t(Xt, At) in condition (iii) and the random variable
2670
+ s−i
2671
+ t
2672
+ in condition (iv) of Definition 7 are functions of (xt, st) whose distribution
2673
+ conditioned on (pi
2674
+ t, ct) is the same as conditioned on (si
2675
+ t, ct) under condition
2676
+ (iii) of Definition 1.
2677
+ However, condition (ii) of Definition 7 may not hold for sufficient private
2678
+ information satisfying Definition 1. Consider the following example. Suppose
2679
+ X1 = Y 1
2680
+ 1 XOR Y 2
2681
+ 1 , and Y 1
2682
+ 1 , Y 2
2683
+ 1 takes values in {0, 1} with equal probability.
2684
+ Z1 = ∅ and Z2 = X1. Then S1
2685
+ 1 = S2
2686
+ 1 = ∅ satisfies Definition 1 because
2687
+ P(x1, s−i
2688
+ 1
2689
+ | pi
2690
+ 1, c1) = P(x1 | yi
2691
+ 1) = 0.5 = P(x1, s−i
2692
+ 1
2693
+ | si
2694
+ 1, c1). However, they don’t
2695
+ satisfy condition (ii) of Definition 7 because P(z2 | p1, c1, a1) = P(x1 | y1
2696
+ 1, y2
2697
+ 1) =
2698
+ 1(x1 = y1
2699
+ 1 XOR y2
2700
+ 1) ̸= P(z2 | s1, c1, a1) = P(x1) = 0.5.
2701
+
2702
+ Springer Nature 2021 LATEX template
2703
+ Dynamic Games with Asymmetric Information and Hidden Actions
2704
+ 31
2705
+ .2 Proof of the generalized better reply secure property
2706
+ for the augmented stage-game
2707
+ We show that when c > 24 the augmented stage-game ˆG1 in Section 6 is
2708
+ generalized better reply secure. For that matter, we set β∗(q) = 1(q ≤ 1/3)
2709
+ and consider the following five cases.
2710
+ Case (i) r0
2711
+ 1(¯α, ¯q) ̸= 0. In this case Bayes’ rule doesn’t hold at (¯α, ¯q). We focus
2712
+ on agent 0 and select the belief to satisfy Bayes’ rule as follows:
2713
+ φ0(˜α, ˜q) = (˜α2p + ˜α1(1 − p), ˜α2(1 − p) + ˜α1p)
2714
+ (95)
2715
+ Then this φ0 is a closed correspondence. From this construction of φ0,
2716
+ we can pick ǫ > 0 such that
2717
+ r0
2718
+ 1(˜α, φ0(˜α, ˜q)) = 0 > r0
2719
+ 1(¯α, ¯q) + ǫ
2720
+ Case (ii) r0
2721
+ 1(¯α, ¯q) = 0, and ¯π−1 ̸= 1/3 and ¯π1 ̸= 1/3.
2722
+ Since β∗(q) = 1 if q < 1/3, β∗(q) = 0 if q > 1/3, β∗(·) is continuous
2723
+ at points where q ̸= 1/3. Hence, we can find ǫ > 0 s.t. β∗(˜q−1) =
2724
+ β∗(¯q−1) for all ˜q−1 ∈ (¯q−1 − ǫ, ¯q−1 + ǫ), and β∗(˜q1) = β∗(¯q1) for all
2725
+ ˜q1 ∈ (¯q1 − ǫ, ¯q1 + ǫ). In this region we have
2726
+ rA
2727
+ 1 (α, ˜q) = rA
2728
+ 1 (α, ¯q)
2729
+ (96)
2730
+ for all α. Let
2731
+ φA(˜α, ˜q) = arg max
2732
+ α
2733
+ rA
2734
+ 1 (α, ˜q)
2735
+ (97)
2736
+ Because rA
2737
+ 1 (·) is continuous in the region under consideration, φA(·)
2738
+ has a closed graph from Berge’s maximum theorem. Note that for all
2739
+ ˜q1 ∈ (¯q1 − ǫ, ¯q1 + ǫ), ˜q1 ∈ (¯q1 − ǫ, ¯q1 + ǫ)
2740
+ rA
2741
+ 1 (φA(˜α, ˜q), ˜q) = max
2742
+ α
2743
+ rA
2744
+ 1 (α, ˜q) = max
2745
+ α
2746
+ rA
2747
+ 1 (α, ¯q)
2748
+ (98)
2749
+ If maxα rA
2750
+ 1 (α, ¯q) > rA
2751
+ 1 (¯α, ¯q) we can find ǫ > 0 such that for ˜q1 ∈
2752
+ (¯q1 − ǫ, ¯q1 + ǫ), ˜q1 ∈ (¯q1 − ǫ, ¯q1 + ǫ), rA
2753
+ 1 (φA(˜α, ˜q), ˜q) = maxα rA
2754
+ 1 (α, ˜q) ≥
2755
+ rA
2756
+ 1 (¯α, ¯q) + ǫ.
2757
+ If maxα rA
2758
+ 1 (α, ¯q) = rA
2759
+ 1 (¯α, ¯q), then Alice has no profitable deviation.
2760
+ Furthermore, since r0
2761
+ 1(¯α, ¯q) = 0, agent 0 has no profitable deviation.
2762
+ Consequently, (¯α, ¯q) is an equilibrium if maxαrA
2763
+ 1 (α, ¯q) = rA
2764
+ 1 (¯α, ¯q).
2765
+ Case (iii) r0
2766
+ 1(¯α, ¯q) = 0, ¯π−1 = 1/3 and ¯π1 ̸= 1/3.
2767
+ Note that ¯q−1 = 0.8¯α1+0.2¯α2 = 1/3 and β∗(¯q−1) = 1/3. Since ¯π1 ̸=
2768
+ 1/3, we can find ǫ > 0 s.t. β∗(˜q1) = β∗(¯q1) for all ˜q1 ∈ (¯q1 − ǫ, ¯q1 + ǫ).
2769
+
2770
+ Springer Nature 2021 LATEX template
2771
+ 32
2772
+ Dynamic Games with Asymmetric Information and Hidden Actions
2773
+ Therefore,
2774
+ rA
2775
+ 1 (¯α, ¯q) = 0.5c(1 − ¯α1 + ¯α2) + 0.5(2 − ¯α1 − ¯α2) + 0.5(3¯q1 − 1)β∗(¯q1)
2776
+ (99)
2777
+ Pick for Alice
2778
+ φA(˜α, ˜q) = (0, 1)
2779
+ (100)
2780
+ for all ˜αi ∈ (¯αi −ǫ, ¯αi+ǫ), i = 1, 2, ˜qi ∈ (¯qi −ǫ, ¯qi+ǫ), i = −1, 1. We get
2781
+ rA
2782
+ 1 (φA(˜α, ˜q), ˜q) =c + 0.5 + 0.5(0.6 − 1)β∗(˜q−1) + 0.5(2.4 − 1)β∗(˜q−1)
2783
+ =c + 0.5 − 0.2β∗(˜q−1) + 0.7β∗(¯q−1)
2784
+ (101)
2785
+ and
2786
+ rA
2787
+ 1 (φA(˜α, ˜q), ˜q) − rA
2788
+ 1 (¯α, ¯q) − ǫ
2789
+ =0.5c(1 + ¯α1 − ¯α2) − 0.5(1 + ¯α1 + ¯α2)
2790
+ − 0.2β∗(˜q−1) + 0.5(2.4 − 3¯q1)β∗(¯q−1) − ǫ
2791
+ ≥0.5c(1 + ¯α1 − ¯α2) − 0.5 ∗ 3 − 0.2 − 0.5 ∗ 0.6 − ǫ
2792
+ (102)
2793
+ When ¯q−1 = 1/3, then 0.8¯α1 + 0.2¯α2 = 1/3 ⇒ ¯α1 = 5/12 − 3/12¯α2.
2794
+ Therefore,
2795
+ 1 + ¯α1 − ¯α2 = 17/12 − 15/12¯α2 ≥ 1/6
2796
+ (103)
2797
+ where the minimum is at ¯α1 = 1/6 and ¯α2 = 1.
2798
+ When c > 24, then
2799
+ 0.5c(1 + ¯α1 − ¯α2) ≥ c/12 > 2
2800
+ (104)
2801
+ and rA
2802
+ 1 (φA(˜α, ˜q), ˜q) − rA
2803
+ 1 (¯α, ¯q) − ǫ > 0.
2804
+ Case (iv) r0
2805
+ 1(¯α, ¯q) = 0, and ¯π1 = 1/3 and ¯π−1 ̸= 1/3.
2806
+ This case is similar to case (iii). Since ¯π−1 ̸= 1/3, we can find ǫ > 0
2807
+ s.t. β∗(˜q−1) = β∗(¯q−1) for all ˜q−1 ∈ (¯q−1 − ǫ, ¯q−1 + ǫ). Furthermore,
2808
+ rA
2809
+ 1 (¯α, ¯q)
2810
+ =0.5c(1 − ¯α1 + ¯α2) + 0.5(2 − ¯α1 − ¯α2) + 0.5(3¯q−1 − 1)β∗(¯q−1)
2811
+ (105)
2812
+ Pick for Alice the closed correspondence (as in case (iii))
2813
+ φA(˜α, ˜q) = (0, 1)
2814
+ (106)
2815
+
2816
+ Springer Nature 2021 LATEX template
2817
+ Dynamic Games with Asymmetric Information and Hidden Actions
2818
+ 33
2819
+ for all ˜αi ∈ (¯αi − ǫ, ¯αi + ǫ), i = 1, 2, ˜qi ∈ (¯qi − ǫ, ¯qi + ǫ), i = −1, 1. Then
2820
+ rA
2821
+ 1 (φA(˜α, ˜q), ˜q)
2822
+ =c + 0.5 − 0.2β∗(¯q−1) + 0.7β∗(˜q−1)
2823
+ (107)
2824
+ and
2825
+ rA
2826
+ 1 (φA(˜α, ˜q), ˜q) − rA
2827
+ 1 (¯α, ¯q) − ǫ
2828
+ =0.5c(1 + ¯α1 − ¯α2) − 0.5(1 + ¯α1 + ¯α2)
2829
+ + 0.5(0.6 − 3¯q−1)β∗(¯q−1) + 0.7β∗(˜q−1) − ǫ
2830
+ ≥0.5c(1 + ¯α1 − ¯α2) − 0.5 ∗ 3 − 0.5 ∗ 2.4 − ǫ
2831
+ (108)
2832
+ When ¯q1 = 1/3, 0.2¯α1+0.8¯α2 = 1/3 ⇒ ¯α2 = 5/12−3/12¯α1. Therefore,
2833
+ 1 + ¯α1 − ¯α2 = 7/12 + 15/12¯α1 ≥ 7/12.
2834
+ (109)
2835
+ When c > 24, then
2836
+ 0.5c(1 + ¯α1 − ¯α2) ≥ 7/24c > 2.7
2837
+ (110)
2838
+ and rA
2839
+ 1 (φA(˜α, ˜q), ˜q) − rA
2840
+ 1 (¯α, ¯q) − ǫ > 0.
2841
+ Case (v) r0
2842
+ 1(¯α, ¯q) = 0, and ¯π1 = 1/3 and ¯π−1 = 1/3.
2843
+ We have
2844
+ rA
2845
+ 1 (¯α, ¯q) = 0.5c(1 − ¯α1 + ¯α2) + 0.5(2 − ¯α1 − ¯α2)
2846
+ (111)
2847
+ Pick for Alice the closed correspondence (as in cases (iii) and (iv))
2848
+ φA(˜α, ˜q) = (0, 1)
2849
+ (112)
2850
+ for all ˜αi ∈ (¯αi − ǫ, ¯αi + ǫ), i = 1, 2, ˜qi ∈ (¯qi − ǫ, ¯qi + ǫ), i = −1, 1. Then
2851
+ rA
2852
+ 1 (φA(˜α, ˜q), ˜q) − rA
2853
+ 1 (¯α, ¯q) − ǫ
2854
+ =0.5c(1 + ¯α1 − ¯α2) − 0.5(1 + ¯α1 + ¯α2) − 0.2β∗(˜q−1) + 0.7β∗(˜q−1) − ǫ
2855
+ ≥0.5c(1 + ¯α1 − ¯α2) − 0.5 ∗ 3 − 0.2 − ǫ
2856
+ (113)
2857
+ Then we have rA
2858
+ 1 (φA(˜α, ˜q), ˜q) − rA
2859
+ 1 (¯α, ¯q) − ǫ > 0 following the steps in
2860
+ (iv).
2861
+ References
2862
+ Aumann R, Maschler M, Stearns R (1995) Repeated games with incomplete
2863
+ information. MIT press
2864
+
2865
+ Springer Nature 2021 LATEX template
2866
+ 34
2867
+ Dynamic Games with Asymmetric Information and Hidden Actions
2868
+ Barelli P, Meneghel I (2013) A note on the equilibrium existence problem in
2869
+ discontinuous games. Econometrica 81(2):813–824
2870
+ Cardaliaguet P, Rainer C, Rosenberg D, et al (2015) Markov games with fre-
2871
+ quent actions and incomplete information—the limit case. Mathematics of
2872
+ Operations Research 41(1):49–71
2873
+ Escobar J, Toikka J (2013) Efficiency in games with Markovian private
2874
+ information. Econometrica 81(5):1887–1934
2875
+ Forges F (1992) Repeated games of incomplete information: non-zero-sum.
2876
+ Handbook of Game Theory 1:109–154
2877
+ Fudenberg D, Tirole J (1991) Game theory. 1991. Cambridge, Massachusetts
2878
+ Gensbittel F, Renault J (2015) The value of Markov chain games with
2879
+ incomplete information on both sides. Mathematics of Operations Research
2880
+ 40(4):820–841
2881
+ Gupta A, Nayyar A, Langbort C, et al (2014) Common information based
2882
+ Markov perfect equilibria for linear-Gaussian games with asymmetric infor-
2883
+ mation. SIAM J Control Optim 52(5):3228–3260
2884
+ Gupta A, Langbort C, Ba¸sar T (2016) Dynamic games with asymmetric infor-
2885
+ mation and resource constrained players with applications to security of
2886
+ cyberphysical systems. IEEE Transactions on Control of Network Systems
2887
+ 4(1):71–81
2888
+ Ho Y (1980) Team decision theory and information structures. Proceedings of
2889
+ the IEEE 68(6):644–654
2890
+ H¨orner J, Sugaya T, Takahashi S, et al (2011) Recursive methods in discounted
2891
+ stochastic games: An algorithm for δ → 1 and a folk theorem. Econometrica
2892
+ 79(4):1277–1318
2893
+ Kartik D, Nayyar A (2021) Upper and lower values in zero-sum stochas-
2894
+ tic games with asymmetric information. Dynamic Games and Applications
2895
+ 11(2):363–388
2896
+ Kumar P, Varaiya P (1986) Stochastic Systems: Estimation Identification and
2897
+ Adaptive Control. Prentice-Hall, Inc.
2898
+ Li L, Shamma J (2014) Lp formulation of asymmetric zero-sum stochastic
2899
+ games. In: 53rd IEEE conference on decision and control, IEEE, pp 1930–
2900
+ 1935
2901
+ Li L, Shamma J (2017) Efficient strategy computation in zero-sum asymmetric
2902
+ repeated games. arXiv preprint arXiv:170301952
2903
+
2904
+ Springer Nature 2021 LATEX template
2905
+ Dynamic Games with Asymmetric Information and Hidden Actions
2906
+ 35
2907
+ Li L, Langbort C, Shamma J (2017) Solving two-player zero-sum repeated
2908
+ Bayesian games. arXiv preprint arXiv:170301957
2909
+ Mailath G, Samuelson L (2006) Repeated Games and Reputations. Oxford
2910
+ university press Oxford
2911
+ Nayyar A, Mahajan A, Teneketzis D (2011) Optimal control strategies in
2912
+ delayed sharing information structures. IEEE Transactions on Automatic
2913
+ Control 56(7):1606–1620
2914
+ Nayyar A, Gupta A, Langbort C, et al (2013a) Common information based
2915
+ markov perfect equilibria for stochastic games with asymmetric information:
2916
+ Finite games. IEEE Transactions on Automatic Control 59(3):555–570
2917
+ Nayyar A, Mahajan A, Teneketzis D (2013b) Decentralized stochastic con-
2918
+ trol with partial history sharing: A common information approach. IEEE
2919
+ Transactions on Automatic Control 58(7):1644–1658
2920
+ Nayyar A, Gupta A, Langbort C, et al (2014) Common information based
2921
+ Markov perfect equilibria for stochastic games with asymmetric informa-
2922
+ tion: Finite games. IEEE Transactions on Automatic Control 59(3):555–570.
2923
+ https://doi.org/10.1109/TAC.2013.2283743
2924
+ Ouyang Y, Tavafoghi H, Teneketzis D (2015) Dynamic oligopoly games with
2925
+ private Markovian dynamics. In: 54th IEEE Conference on Decision and
2926
+ Control (CDC)
2927
+ Ouyang Y, Tavafoghi H, Teneketzis D (2017) Dynamic games with asymmetric
2928
+ information: Common information based perfect Bayesian equilibria and
2929
+ sequential decomposition. IEEE Transactions on Automatic Control
2930
+ Renault J (2006) The value of Markov chain games with lack of information
2931
+ on one side. Math Oper Res 31(3):490–512
2932
+ Renault J (2012) The value of repeated games with an informed controller.
2933
+ Mathematics of Operations Research 37(1):154–179
2934
+ Sinha A, Anastasopoulos A (2016) Structured perfect Bayesian equilibrium
2935
+ in infinite horizon dynamic games with asymmetric information. American
2936
+ Control Conference
2937
+ Sugaya T (2012) Efficiency in Markov games with incomplete and private
2938
+ information. working paper
2939
+ Tang D, Tavafoghi H, Subramanian V, et al (2022) Dynamic games among
2940
+ teams with delayed intra-team information sharing. Dynamic Games and
2941
+ Applications pp 1–59
2942
+
2943
+ Springer Nature 2021 LATEX template
2944
+ 36
2945
+ Dynamic Games with Asymmetric Information and Hidden Actions
2946
+ Tavafoghi H, Ouyang Y, Teneketzis D (2016) On stochastic dynamic games
2947
+ with delayed sharing information structure. In: 55th IEEE Conference on
2948
+ Decision and Control (CDC), pp 7002–7009
2949
+ Tavafoghi H, Ouyang Y, Teneketzis D (2022) A unified approach to
2950
+ dynamic decision problems with
2951
+ asymmetric information: Nonstrate-
2952
+ gic agents. IEEE Transactions on Automatic Control 67(3):1105–1119.
2953
+ https://doi.org/10.1109/TAC.2021.3060835
2954
+ Vasal D, Anastasopoulos A (2016) Signaling equilibria for dynamic LQG games
2955
+ with asymmetric information. In: 55th IEEE Conference on Decision and
2956
+ Control (CDC), pp 6901–6908
2957
+ Witsenhausen HS (1973) A standard form for sequential stochastic control.
2958
+ Mathematical Systems Theory 7(1):5–11
2959
+ Zamir S (1992) Repeated games of incomplete information: Zero-sum. Hand-
2960
+ book of Game Theory 1:109–154
2961
+ Zheng J, Casta˜n´on DA (2013) Decomposition techniques for markov zero-sum
2962
+ games with nested information. In: 52nd IEEE conference on decision and
2963
+ control, IEEE, pp 574–581
2964
+
5NE4T4oBgHgl3EQf1Q0a/content/tmp_files/load_file.txt ADDED
The diff for this file is too large to render. See raw diff
 
5dE1T4oBgHgl3EQfmgRl/vector_store/index.pkl ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:4c4ef6f83f5da36cd3419d6a2b81a8f05a98e17cb5770fdb8a47aaa1703bf677
3
+ size 314157
6dE0T4oBgHgl3EQffAAW/vector_store/index.faiss ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:fbcc6c176cf6a82b6b4e1c66b8a2f8356ab61463a5fb0db5b1a826f7008286f2
3
+ size 5701677
9dE0T4oBgHgl3EQffwCf/content/2301.02409v1.pdf ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:b2272d92685f8df5e66d704b6908e9f8d3b282a50fb9fccaee1bd9af102b2a40
3
+ size 2132586
9dE0T4oBgHgl3EQffwCf/vector_store/index.pkl ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:3fe12e213d143f9f3a053a45983d9bdcd0d3f25553259884e88a7dbac6580cf2
3
+ size 458856
9tE0T4oBgHgl3EQfwwGF/content/tmp_files/2301.02637v1.pdf.txt ADDED
@@ -0,0 +1,2147 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ A quantum pricing-based column generation framework for hard combinatorial problems
2
+ Wesley da Silva Coelho,1, ∗ Lo¨ıc Henriet,1 and Louis-Paul Henry1
3
+ 1PASQAL SAS, 7 rue L´eonard de Vinci, 91300 Massy, France
4
+ (Dated: January 9, 2023)
5
+ In this work, we present a complete hybrid classical-quantum algorithm involving a quantum
6
+ sampler based on neutral atom platforms. This approach is inspired by classical column generation
7
+ frameworks developed in the field of Operations Research and shows how quantum procedures can
8
+ assist classical solvers in addressing hard combinatorial problems. We benchmark our method on the
9
+ Minimum Vertex Coloring problem and show that the proposed hybrid quantum-classical column
10
+ generation algorithm can yield good solutions in relatively few iterations. We compare our results
11
+ with state-of-the-art classical and quantum approaches.
12
+ INTRODUCTION
13
+ Combinatorial optimization is at the heart of many real-
14
+ world problems. It consists in finding the “best” out of a
15
+ finite, but prohibitively large, set of options. Column gener-
16
+ ation [1] is an iterative method that was developed to solve
17
+ this kind of difficult mathematical problems, such as linear
18
+ formulations where the problem may be too large to consider
19
+ all options explicitly. In this method, variables are associated
20
+ with each option. The algorithm starts by solving the con-
21
+ sidered problem with a limited set of variables (or options),
22
+ known as restricted master problem (RMP), and then itera-
23
+ tively adds variables to improve the objective function. The
24
+ generation of new variables is done by an algorithm specifi-
25
+ cally tailored to this task: during each iteration, the related
26
+ new sub-problem to be solved, usually referred to as pric-
27
+ ing sub-problem (PSP), relies on the duality theory [2] to
28
+ provide new variables, if there exists any, only if they can
29
+ improve the current solution of the restricted master prob-
30
+ lem. The iterative process stops when new variables cease to
31
+ improve the objective function, which is proven mathemati-
32
+ cally. However, solving the pricing sub-problems usually rep-
33
+ resents the bottleneck of the column generation approach as
34
+ it comes to solving several simpler, but still hard, optimiza-
35
+ tion problems. Hence, designing an efficient way to solve the
36
+ pricing sub-problems is the most important step to ensure
37
+ high-quality solutions to the RMP while minimizing time
38
+ and resource consumption.
39
+ During the past years, both academic and industrial com-
40
+ munities have been putting a lot of effort into designing
41
+ quantum hardware and algorithms that could provide a real
42
+ advantage over classical computers. As pointed out in [3],
43
+ this advantage can take the form of more accurate results,
44
+ a faster convergence, or even a lower energy consumption.
45
+ Such quantum algorithms can be used along with state-of-
46
+ the-art classical solutions, such as the column generation al-
47
+ gorithm, to create powerful hybrid classical-quantum frame-
48
+ works. A wide spectrum of quantum computing platforms
49
+ is currently being developed, using different kinds of two-
50
+ level systems as qubits, including Josephson junctions [4, 5],
51
+ trapped ions [6, 7], photons [8], or neutral atoms [9, 10].
52
+ Each of these allows for different quantum processing unit
53
+ (QPUs) architectures, with their own advantages and limi-
54
+ tations when it comes to the connectivity of the qubits, or
55
+ the types of operations that are easily implemented. A good
56
+ knowledge of these platforms allows for the development of
57
+ hardware-efficient approaches, designed specifically for each
58
+ ∗ wesley.coelho@pasqal.com
59
+ FIG. 1: Workflow of the hybrid classical-quantum column
60
+ generation approach. First, a minimal sub-set x of variables
61
+ is generated in such a way that it ensures a feasible solu-
62
+ tion for the Reduced Master Problem (e.g., with only the
63
+ singletons of the graph). The RMP is then solved by a clas-
64
+ sical solver. The next steps are related to the pricing sub-
65
+ problems, which are solved by considering the dual values
66
+ from the solved RMP in order to find more variables that
67
+ can potentially improve the current solution of the RMP.
68
+ If such variables exist, then RMP is updated with the new
69
+ variables and is solved again. The search for new variables is
70
+ done by a quantum sampler specifically tailored to consider
71
+ different inputs related to each pricing iteration. These last
72
+ steps are repeated until no column is generated by the PSP.
73
+ of them. In particular, this allows for identifying the classi-
74
+ cal bottlenecks that are best suited for being replaced by a
75
+ quantum approach.
76
+ In this work, we propose a complete hybrid classical-
77
+ quantum column generation framework whose pricing sub-
78
+ problems can be efficiently solved on neutral atom-based
79
+ QPUs. Unlike other hybrid approaches like QAOA, the core
80
+ part of the resolution is here carried out by a classical solver,
81
+ and the quantum processing unit is used as a sampler to
82
+ restrict the search space. Requiring only |V | qubits for a
83
+ given graph G
84
+ = (V, E), the related pricing sub-problems
85
+ are then solved by a neutral atom-based sampler specifically
86
+ tailored to improve the current solution of the associated
87
+ master problem. Compared to classical and quantum greedy
88
+ approaches, we show numerically that the proposed hybrid
89
+ column generation can improve significantly the quality of
90
+ the solutions while reducing the number of iterations on the
91
+ quantum device. Finally, by taking advantage of some quan-
92
+ arXiv:2301.02637v1 [quant-ph] 6 Jan 2023
93
+
94
+ Pre-Processing
95
+ Solving RMP
96
+ Post-Processing
97
+ Master Problem
98
+ (Re)Build RMP
99
+ Classical
100
+ Graph Weighting
101
+ Solver
102
+ Feasible Solutions
103
+ min cty
104
+ s.t.
105
+ Ay ≤B
106
+ Pre-Processing
107
+ Sampling
108
+ Sampled Solutions
109
+ Variable Set Update
110
+ Register Design
111
+ BS Count Cost
112
+ Quantum Sampler
113
+ 00000
114
+ 0
115
+ Pricing
116
+ 000111
117
+ 100
118
+ 30
119
+ QPU
120
+ 01010
121
+ 6
122
+ 0.5
123
+ Pulse Shaping
124
+ 01011
125
+ 250
126
+ 40
127
+ 00101
128
+ 3
129
+ 1
130
+ 11111
131
+ 0
132
+ -102
133
+ tum features (e.g., state superposition), we find that the hy-
134
+ brid column generation method returns the (near-)optimal
135
+ solution faster than the classical one (i.e., where no QPU is
136
+ involved). Fig. 1 summarizes our proposed approach.
137
+ This paper is structured as follows : We first introduce the
138
+ main aspects of the graph theory and the related combina-
139
+ torial problems in Section I. After reviewing related works
140
+ in Section II, we give a brief introduction to neutral atom-
141
+ based quantum computing the Section III. We dedicate Sec-
142
+ tion IV to introduce the main idea of the column generation
143
+ approach. In Section V, we present in-depth our proposed
144
+ hybrid classical-quantum approach to solving the Minimum
145
+ Vertex Coloring Problem (MVCP), while the results of our
146
+ numerical experiments are discussed in Section VI.
147
+ I.
148
+ BACKGROUND
149
+ Combinatorial problems [11] have been extensively stud-
150
+ ied by both academic and industrial communities, and have
151
+ a vast range of applications in real-world systems.
152
+ Those
153
+ problems can naturally be defined on graphs, which are data
154
+ structures composed of a set of elements called vertices (also
155
+ known as nodes) that can potentially be connected. These
156
+ connections are called edges and might potentially encode
157
+ different information, such as the importance of such connec-
158
+ tions (as weights) or the distance between their endpoints.
159
+ Similarly, different labels and weights can also be associ-
160
+ ated with vertices in order to differentiate them. Formally, a
161
+ graph G = (V, E) is composed of a set of vertices V and edges
162
+ E ∈ V2 representing the existence of a connection between
163
+ vertices u and v from V.
164
+ Several real-world optimization problems, from a vast
165
+ spectrum of fields, can be mapped to graph problems. For in-
166
+ stance, graphs can be used to encode social experiments [12],
167
+ telecommunication networks [13], and physical systems [14].
168
+ The related optimization problems typically consist in se-
169
+ lecting a subset of vertices and/or edges optimally satisfying
170
+ certain rules. This kind of discrete optimization problem is
171
+ highly relevant for Quantum Computing (QC), particularly
172
+ in the case of Noisy Intermediate-Scale Quantum (NISQ)-era
173
+ platforms [15, 16]. In that case, results are typically obtained
174
+ via repeated measurements of the final state of the system.
175
+ The solutions are then inferred by the selection of the best
176
+ sampled state through computationally cheap classical post-
177
+ processing.
178
+ In the case of neutral atom QPUs, the spatial arrange-
179
+ ment of qubits can be made such that the Ising Hamiltonian
180
+ describing the interactions in the system is closely related to
181
+ a given cost function to be minimized. This is what makes
182
+ this platform notably well suited to solving graph combina-
183
+ torial problems [17–20]. As the state of the computational
184
+ basis in which the qubits are measured has a direct corre-
185
+ spondence to the solution to the graph problem, this type of
186
+ QC is particularly robust to noise (noise can even be an ad-
187
+ vantage [21]). For instance, Maximum Independent Set [22]
188
+ and Maximum Cut [3] problems can be efficiently solved by
189
+ approaching the ground state of the quantum system with
190
+ adiabatic annealing [18, 23] or similar methods. In the fol-
191
+ lowing, we formally defined some graph problems and show
192
+ how they can be solved by quantum-based approaches.
193
+ A.
194
+ Combinatorial problems
195
+ In the following, we present the Maximum Independent
196
+ set, which is a fundamental part of the proof of concept of
197
+ our hybrid approach. Then, we formally define the Vertex
198
+ coloring problem and present the related mathematical for-
199
+ mulation.
200
+ 1.
201
+ Maximum Independent Set problem
202
+ An independent set in a graph G = (V, E) is a subset
203
+ of vertices ˜V ⊂ V such that no pair of elements from ˜V
204
+ is connected by an edge.
205
+ The independent sets of G can
206
+ formally be defined as follows:
207
+ ISG =
208
+
209
+ ˜V ⊂ V
210
+ �� ˜V2 ∩ E = ∅
211
+
212
+ (1)
213
+ where ˜V2 are all the possible edges connecting the vertices in
214
+ ˜V. Therefore, the Maximum Independent Set (MIS) is the
215
+ largest set of ISG:
216
+ MIS(G) = argmax
217
+ ˜V∈ISG
218
+ |˜V|.
219
+ (2)
220
+ The MIS problems can be alternatively described in
221
+ terms of their quadratic unconstrained binary optimization
222
+ (QUBO) formulations. Consider a graph G = (V, E). Let
223
+ xu be a binary variable associated with each vertex u ∈ V,
224
+ and that holds 1 if vertex u is selected to be in the in-
225
+ dependent set, and 0 otherwise. Hence, the binary vector
226
+ x = {x1, . . . , x|V|} can be put in one-to-one correspondence
227
+ with partitions ˜V of the vertex set V via the identification:
228
+ ˜V(x) =
229
+
230
+ u ∈ V
231
+ �� xu = 1
232
+
233
+ (3)
234
+ The solution to the maximum (weighted) independent set
235
+ problem is then given by:
236
+ MIS(G) = argmin
237
+ x∈{0,1}|V|
238
+
239
+ �−
240
+
241
+ u∈V
242
+ wuxu + α
243
+
244
+ {u,v}∈E
245
+ xuxv
246
+
247
+
248
+ (4)
249
+ where the parameter wu represents the weight associated
250
+ to each vertex u ∈ V, while α > 0 is an arbitrary coefficient
251
+ to penalize unfeasible solutions. Note that, on unweighted
252
+ graphs, the penalty coefficient α as well as all w parameters
253
+ are set to 1.
254
+ 2.
255
+ Minimum Vertex Coloring problem
256
+ The Vertex Coloring problem has several applications in
257
+ real-world optimization problems such as network design [24]
258
+ and task scheduling [25].
259
+ A vertex coloring is an assign-
260
+ ment of colors (or labels) to each vertex of a graph such that
261
+ any two identically colored vertices are not connected by an
262
+ edge. The Minimum Vertex Coloring problem consists then
263
+ in finding a feasible coloring while minimizing the number
264
+ of colors (or labels) assigned; the minimum number of col-
265
+ ors used to color all vertices of a given graph G is called its
266
+ chromatic number, hereafter denoted X(G). The Minimum
267
+ vertex coloring can be formally defined as follows:
268
+
269
+ 3
270
+ (a) Trivial coloring.
271
+ (b) Optimal coloring.
272
+ FIG. 2: Two coloring solutions to the same graph with 5
273
+ vertices, 6 edges, and X(G) = 3. The set C has 5 available
274
+ colors: green, brown, orange, purple, and yellow.
275
+ Definition 1 Let G
276
+ =
277
+ (V, E) be a graph with a set
278
+ V
279
+ =
280
+ {u1, .., u|V|} of vertices and a set E ⊂ V2 of edges.
281
+ Also, let C be a set of available colors. The Minimum Ver-
282
+ tex Coloring Problem consists in coloring each vertex of G
283
+ with exactly one color from C in a such way that the num-
284
+ ber of used colors is minimized while ensuring that no two
285
+ adjacent vertices have the same color.
286
+ Figure 2 shows two possible coloring solutions for the same
287
+ graph. By applying a trivial coloring (see Fig. 2a), each color
288
+ is mapped to exactly one vertex; this simple approach always
289
+ gives a feasible solution to the problem. As shown in Fig. 2b,
290
+ however, the related chromatic number (i.e., the optimal so-
291
+ lution) can be reduced to 3. It is worthwhile to notice that,
292
+ given a feasible solution for the Vertex Coloring problem,
293
+ any sub-set of vertices colored with the same color is also
294
+ an independent set. Hence, finding the minimum sub-set of
295
+ independent sets that cover all vertices of a given graph G is
296
+ equivalent to solving the MVCP in the same graph. Finding
297
+ the chromatic number of a graph, however, is one of Karp’s
298
+ 21 NP-complete problems [26].
299
+ B.
300
+ An extended formulation for the Minimum Vertex
301
+ Coloring problem
302
+ We now present an extended formulation1 for the Min-
303
+ imum Vertex Coloring Problem, which is used within our
304
+ proposed hybrid approach. First, let S be a set of all possi-
305
+ ble independent sets in the graph G = (V, E). Also, let bus
306
+ be a binary parameter that holds 1 if the vertex u ∈ V is
307
+ present in the independent set s ∈ S, and 0 otherwise. Fi-
308
+ nally, we associate a binary variable ys to each independent
309
+ set s ∈ S; it takes 1 if the related independent set is selected;
310
+ 0 otherwise. Solving the MVCP comes then to solving the
311
+ following extended formulation:
312
+ min
313
+
314
+ s∈S
315
+ ys
316
+ (5)
317
+ s.t.,
318
+
319
+ s∈S
320
+ busys = 1,
321
+ ∀u ∈ V
322
+ (6)
323
+ ys ∈ {0, 1},
324
+ ∀s ∈ S
325
+ (7)
326
+ 1 Extended formulations are mathematical models in which the num-
327
+ ber of variables grows exponentially as the input increases.
328
+ where (5) is set to minimize the number of selected inde-
329
+ pendent sets, while ensuring that each vertex of the graph
330
+ is present in exactly one of them (see equation (7)). Note
331
+ that, by considering each independent set s ∈ S as a color
332
+ assignment, the adjacency constraints related to the Mini-
333
+ mum Vertex Coloring problem are automatically respected
334
+ (see definition (1)).
335
+ The number of all independent sets in a graph, and hence
336
+ the number of ys variables, can be extremely large, expo-
337
+ nentially growing as the number of vertices in the graph
338
+ increases.
339
+ Hence, as one may anticipate, finding all such
340
+ sets on a given graph is a very hard task and can be very
341
+ time and resource-consuming even for small instances. To
342
+ overcome the aforementioned limitations, we propose a hy-
343
+ brid classical-quantum column generation-based framework
344
+ to efficiently solve the proposed extended formulation by
345
+ enumerating only a small subset of independent sets.
346
+ In
347
+ what follows, we present the related works and discuss how
348
+ a quantum sampler can be integrated into classical frame-
349
+ works.
350
+ II.
351
+ RELATED WORK
352
+ Several quantum algorithms have been proposed for solv-
353
+ ing graph coloring problems in the past years, and most of
354
+ them rely on a quantum annealing-based approach. In [27],
355
+ the authors investigate a real-time quantum dynamics-based
356
+ quantum annealing approach where the related Hamilto-
357
+ nian is designed to naturally respect all problem-related con-
358
+ straints without adding penalty terms. Authors in [28], on
359
+ the other hand, propose a genetic algorithm-based quantum
360
+ approach to solve both vertex and edge coloring problems in
361
+ different highly configurable circuit-based models. Titiloye
362
+ and Crispin [29] compare classical and quantum annealing
363
+ approaches in solving graph coloring problems. According to
364
+ the authors, the path-integral Monte Carlo-based quantum
365
+ annealing (QA) algorithm outperforms its classical counter-
366
+ part.
367
+ Authors in [30] propose another approach in which the
368
+ problem-related set of constraints is transformed into an
369
+ energy minimization problem to output a QUBO formula-
370
+ tion, which is then solved in a quantum annealer platform.
371
+ However, by running various numerical simulations and com-
372
+ paring results obtained with standard and enhanced circuit-
373
+ based QAOA algorithms, authors in [31] indicate the limi-
374
+ tation of the existing QA hardware solutions for solving the
375
+ Vertex Coloring problem. Also, Silva et al [32] compare sim-
376
+ ulated and quantum annealing approaches for solving the
377
+ proposed QUBO formulation for the Vertex Coloring prob-
378
+ lem. Using D-Wave 2X as an independent set sampler for
379
+ a simple greedy framework, the authors show that the pro-
380
+ posed quantum sampler could improve the results with high
381
+ probability on small graphs due to hardware limitations.
382
+ Fabrikant and Hogg [33] introduce a quantum heuristic for
383
+ graph coloring for instances that can be solved with at most
384
+ 3 colors. Using two qubits to each vertex of the graph, an
385
+ approximate asymptotic analysis suggests polynomial-time
386
+ cost for solving the related 3-coloring problem. Moreover,
387
+ authors in [34] introduce an exponential-space quantum al-
388
+ gorithm to solve the MVCP in O(1.9140|V|) running time.
389
+ They propose a quantum random access memory framework
390
+ based on Ambainis quantum dynamic programming [35]
391
+ with applications of Grover’s search to branching algorithms.
392
+
393
+ 4
394
+ Moreover, authors in [36] proposed a greedy quantum algo-
395
+ rithm for solving the MVCP by iteratively computing the
396
+ solutions of Maximum Independent Set problems. By sim-
397
+ ulating a framework on a classical computer to reproduce
398
+ the Rydberg blockade phenomenon on neutral atoms-based
399
+ QPUs, they show that their approach can always find fea-
400
+ sible solutions for the problem.
401
+ More details about their
402
+ approach are presented in Appendix A.
403
+ Finally, authors in [37] propose a quantum annealing-
404
+ based method to solve one of the two pricing sub-problems of
405
+ a column generation-based approach for the refinery schedul-
406
+ ing problem.
407
+ They first decompose the problem into one
408
+ master problem and two pricing sub-problems and formu-
409
+ late one of them as a QUBO model. While only the QUBO-
410
+ related pricing sub-problem is solved using a quantum an-
411
+ nealing approach, the master and the other pricing sub-
412
+ problem are solved with a classical solver.
413
+ The quantum
414
+ system is based on D-Wave’s quantum annealers and is de-
415
+ signed to return only the optimal solution.
416
+ Due to some
417
+ serious limitations either related to the problem size or to
418
+ the connectivity of its variables, the authors could guaran-
419
+ tee high-quality solutions for only a few instances of small
420
+ graphs.
421
+ Note that, even though those works propose interesting
422
+ approaches to solving combinatorial problems (sometimes
423
+ only the decision version), little attention has been given
424
+ to hybrid and analog approaches, especially using neutral
425
+ atoms-based QPUs. In what follows, we introduce a com-
426
+ plete quantum pricing framework based on neutral atom
427
+ QPUs that can be easily embedded into a column genera-
428
+ tion algorithm to solve hard combinatorial problems, such
429
+ as graph coloring problems.
430
+ III.
431
+ NEUTRAL ATOM QPUS
432
+ In neutral atom-based QPUs, lasers or microwaves are
433
+ used to induce transitions between electronic states of the
434
+ valence electron of alkali metal (typically Rubidium) atoms.
435
+ Different pairs of electronic levels can be used as qubits.
436
+ Here, we will solely focus on the case where those two states
437
+ are the electronic ground state |g⟩ ≡ |0⟩ and a s− Rydberg
438
+ level |r⟩ ≡ |1⟩. In that case, atoms can be placed arbitrarily
439
+ in space, so that the effective Hamiltonian of the atoms at
440
+ time t can be written as
441
+ H(t) = Ω(t)
442
+ |V|
443
+
444
+ u=1
445
+ ˆσx
446
+ u − ∆(t)
447
+ |V|
448
+
449
+ u=1
450
+ ˆnu +
451
+ |V|
452
+
453
+ u<v=1
454
+ Uuvˆnuˆnv,
455
+ (8)
456
+ where the amplitude (giving the Rabi frequency) Ω(t) and
457
+ detuning ∆(t) of the laser can be controlled over time, and
458
+ the interaction strength Uuv ∝ |ru − rv|−6 is a function of
459
+ the distance between atom u and atom v. Throughout this
460
+ paper, we set ℏ = 1.
461
+ Note that in the current work, we
462
+ consider only a uniform global laser control over the atoms.
463
+ A key property of Rydberg physics is the so-called Ryd-
464
+ berg blockade mechanism [9] : the two-body interaction term
465
+ in (8) forbids the simultaneous excitation of two atoms that
466
+ are closer than a certain distance. Given a set of atoms and
467
+ their positions, one can then define a graph such that each
468
+ atom corresponds to a vertex and in such a way that two
469
+ vertices are connected by an edge if and only if the distance
470
+ between the related atoms is shorter than a given threshold.
471
+ This kind of graphs are known as Unit-Disk graphs, and they
472
+ are the most natural graphs to encode in a neutral atom
473
+ QPU. For this graph class, one can ensure that the evolu-
474
+ tion of the quantum system is restricted to a subspace of the
475
+ complete Hilbert space corresponding to independent sets
476
+ of the graph. By setting Ω(t) = 0 and adjusting the value
477
+ of ∆, one can ensure that the ground-state corresponds to
478
+ an MIS. Because of these properties, people have explored
479
+ Quantum Annealing as a way to solve optimization prob-
480
+ lems on graphs [38]. For non-UD graphs, however, one can
481
+ construct alternative approaches, similar to what is done in
482
+ QAOA, or Variational Quantum Eigensolvers [39].
483
+ IV.
484
+ PROBLEM DECOMPOSITION
485
+ We dedicate this section to fully describing the decompo-
486
+ sition of the proposed extended formulation (5)-(7), a fun-
487
+ damental step to solve the related combinatorial problem
488
+ with a column generation-based algorithm. The need of ap-
489
+ plying such a mathematical strategy comes from the fact
490
+ that, in most of the cases, generating all elements that will
491
+ be related to the variables of an extended formulation is a
492
+ very hard task. For instance, enumerating all independent
493
+ sets of a graph can be impractical even for small instances.
494
+ To overcome the aforementioned issue, we decompose the
495
+ problem under consideration into two problems, named Re-
496
+ stricted Master Problem (RMP) and Princing Sub-Problem
497
+ (PSP). While the former has only a small subset of variables
498
+ needed to find a solution to the problem, the latter is de-
499
+ signed to provide new elements (e.g., independent sets) that
500
+ respect all technical constraints imposed by the RMP. These
501
+ new elements are then added as new variables (also seen as
502
+ columns) to the mathematical model related to the RMP as
503
+ they might potentially improve the quality of the solution
504
+ (e.g., decreasing the number of colors needed to solve the
505
+ Vertex Coloring problem).
506
+ Column generation-based approaches rely on the duality
507
+ theory [40], which states that optimization problems can be
508
+ addressed from two different perspectives: the primal prob-
509
+ lem or its counterpart, the dual problem. The relationship
510
+ between these two problems is the following: (i) for each
511
+ variable (resp. constraint) in the primal problem, there is a
512
+ related constraint (resp. variable) in the dual problem, and
513
+ (ii) the optimization direction (e.g., maximization or mini-
514
+ mization) on the dual is inversed related to its primal coun-
515
+ terpart. For each sub-optimal solution that satisfies all the
516
+ constraints on the primal problem, there is at least one di-
517
+ rection to move in such a way that the objective function is
518
+ improved. Such improving directions are represented by the
519
+ vector of dual variables and optimizing them is equivalent
520
+ to tightening the bounds of the primal problem. For an in-
521
+ depth discussion on the primal-dual relationship, one may
522
+ refer to [40]. After solving a linear model related to a primal
523
+ problem, one can easily get such a direction vector (i.e., dual
524
+ variables) by calling some built-in function proposed by the
525
+ solver used in the process.
526
+ In order to design an efficient column generation frame-
527
+ work, the PSP is then formulated in such a way to incorpo-
528
+ rate the dual information provided by current solutions of
529
+ the RMP, which implies solving a different pricing instance
530
+ each time the sub-problem is called.
531
+ Hence, by applying
532
+ the duality theory, the PSP searches for new variables that
533
+ can improve the objective function of the RMP, and once
534
+ it is mathematically proven that it is no longer possible to
535
+
536
+ 5
537
+ generate such variables (i.e., new columns), the loop-based
538
+ procedure stops. This approach is very powerful when only
539
+ a few variables are normally activated (i.e., taking any value
540
+ other than zero) in the optimal solution to a given combi-
541
+ natorial problem. Hence, applying such a technique, only a
542
+ very small subset of variables is needed to be generated by
543
+ the pricing routine.
544
+ In what follows, we present a decomposition scheme for
545
+ solving the proposed extended formulation for the MVCP.
546
+ The main idea relies on generating a restricted model with
547
+ only a sub-set of independent sets and iteratively updating
548
+ it with new variables (i.e., columns) that have the potential
549
+ to improve the current solution.
550
+ A.
551
+ The restricted master problem
552
+ Since G has an exponential number of potentially suitable
553
+ colorings represented by the related set S of independent
554
+ sets, the extended formulation (5)-(7) admits an exponential
555
+ number of variables. To overcome the difficulty of generating
556
+ S, we propose to generate only a small sub-set S′ ⊆ S of
557
+ variables that are needed to solve the master problem. For
558
+ instance, a trivial solution might be initializing S′ with only
559
+ the singletons of the input graph. The reduced model is then
560
+ hereafter referred to as Restricted Master Problem (RMP),
561
+ and can be defined as follows:
562
+ min
563
+
564
+ s∈S′
565
+ ys
566
+ (9)
567
+ s.t.,
568
+
569
+ s∈S′
570
+ busys = 1,
571
+ ∀u ∈ V
572
+ (10)
573
+ 0 ≤ ys ≤ 1,
574
+ ∀s ∈ S′
575
+ (11)
576
+ Note that, in order to apply the duality theory, we must
577
+ solve the linear relaxation on the RMP, meaning the y vari-
578
+ ables are no longer binary in this formulation. The RMP is
579
+ then solved again with the integrality constraints (7) once it
580
+ has all variables needed to provide the optimal solution for
581
+ the relaxed RPM, which can be proven mathematically; we
582
+ provide this proof in the following section.
583
+ B.
584
+ Pricing sub-problems
585
+ We present first the dual formulation related to the relaxed
586
+ RMP (9)-(11). By associating a dual variable wu to each
587
+ constraint in (10), we define the dual problem as follows:
588
+ max
589
+
590
+ u∈V
591
+ wu
592
+ (12)
593
+ s.t.,
594
+
595
+ u∈V
596
+ wubus ≤ 1,
597
+ ∀s ∈ S′
598
+ (13)
599
+ wu ∈ R,
600
+ ∀u ∈ V
601
+ (14)
602
+ The separation of inequalities (13) represents the pricing
603
+ sub-problems related to the extended formulation (9)-(11).
604
+ The PSP consists then in finding a new coloring set in such a
605
+ way that all adjacency constraints would be respected while
606
+ improving the solution cost of RMP (i.e., decreasing the
607
+ value of the objective function (9)). For this purpose, let
608
+ ¯wu be the components of the current dual solution of the
609
+ RMP related to constraints (10). By setting each dual vari-
610
+ able ¯wu as the weight of the related vertex u ∈ V, finding a
611
+ new independent set under such conditions comes to solving
612
+ the following maximum weighted independent set (MWIS)
613
+ formulation:
614
+ max
615
+
616
+ u∈V
617
+ ¯wuxu
618
+ (15)
619
+ s.t.,
620
+ xu + xv ≤ 1,
621
+ ∀(u, v) ∈ E
622
+ (16)
623
+ xu ∈ {0, 1},
624
+ ∀u ∈ V
625
+ (17)
626
+ where xu is a binary variable that holds 1 if it is in the in-
627
+ dependent set; 0 otherwise. Inequalities (16) ensures that
628
+ the new independent set respects the adjacency constraints.
629
+ Note that the pricing formulation (15)-(17) is an Integer Pro-
630
+ gramming (IP) version of the QUBO formulation (4).
631
+ The net gain of adding a new variable related to a solution
632
+ to the pricing problem is given by the reduced cost. Based
633
+ on the separation of inequalities (13), we calculate the re-
634
+ duced cost rs for any independent set s given by solving the
635
+ formulation (15)-(17) as following:
636
+ rs = 1 −
637
+
638
+ u∈V
639
+ ¯wuxu
640
+ (18)
641
+ Since we minimize the master problem in the work, any
642
+ solution with a negative reduced cost might potentially im-
643
+ prove the solution of the RMP. The pricing problem consists
644
+ then in finding a new independent set s whose total weight is
645
+ strictly greater than 1; the total weight of any independent
646
+ set is calculated as in the cost function (15). Hence, any
647
+ solution to the formulation (15)-(17) whose cost is greater
648
+ than 1 can therefore be added to the sub-set S′; if such a
649
+ solution does not exist, then the solution of the RMP can-
650
+ not be improved and, hence, the optimal solution the relaxed
651
+ RPM can be achieved with the current variables related to
652
+ the sub-set S′.
653
+ V.
654
+ SOLVING METHOD
655
+ As previously discussed, solving the pricing sub-problems
656
+ is usually the bottleneck in column generation-based algo-
657
+ rithms since it comes to solving different instances of a hard
658
+ combinatorial problem multiple times.
659
+ To overcome this
660
+ problem, we propose a quantum pricing algorithm that can
661
+ find the (near-) optimal solution faster than the classical
662
+ one (i.e., where no QPU is involved). For this purpose, let
663
+ us now describe the column generation-based framework pro-
664
+ posed to solve the Minimum Vertex Coloring problem; which
665
+ is summarized in Fig. 3.
666
+ First, a minimal sub-set S′ ⊆ S of independent sets is
667
+ generated in such a way that it ensures a feasible solution for
668
+ the extended formulation (5)-(7). As previously discussed,
669
+ the most trivial way to build the initial set S′ of independent
670
+
671
+ 6
672
+ Create the initial set S
673
+ of possible independent
674
+ sets (IS) that give a
675
+ feasible solution
676
+ Generate the
677
+ Reduced Master
678
+ Problem (RMP)
679
+ Solve the relaxed
680
+ RMP with the current
681
+ set S
682
+ Get the dual
683
+ variables
684
+ Generate the Pricing
685
+ Sub-Problem (PSP)
686
+ with the dual
687
+ variables
688
+ Solve the PSP
689
+ Update S with the
690
+ new set(s) found by
691
+ PSP
692
+ Solve the 0-1 RMP
693
+ with the final set S
694
+ No
695
+ Yes
696
+ Stop
697
+ Criteria ?
698
+ Problems's
699
+ instance
700
+ Final coloring
701
+ solution
702
+ FIG. 3: Interaction between the restricted master problem
703
+ and the sub-problem
704
+ sets is generating only the singletons in the graph; this simple
705
+ approach always provides a solution for the RMP.
706
+ The classical part of the proposed hybrid approach is re-
707
+ lated to the Restricted Master.
708
+ Once the initial set S′ is
709
+ created, the RMP is built and then solved on its linear re-
710
+ laxation form (see formulation (9)-(11)) by a classical solver
711
+ (e.g., GPLK). The values of the dual variables are also given
712
+ by the classical solver by running a built-routine after solv-
713
+ ing each version of the RMP (i.e., with different sub-sets of
714
+ variables).
715
+ The next steps are related to the pricing sub-problems,
716
+ in which the PSP is solved by applying the values of the
717
+ related dual variables from the solved RMP. As previously
718
+ discussed, this step comes to finding independent sets whose
719
+ weight is strictly greater than 1. If such elements exist, then
720
+ they are added to S′.
721
+ As we detail in the following, we
722
+ propose a quantum sampler that is specifically tailored to
723
+ output multiple independent under the aforementioned con-
724
+ ditions For each new independent set found by solving the
725
+ related pricing sub-problem, a new variable is created and
726
+ added to the sub-set S′.
727
+ Then, the RMP is solved again
728
+ with the new columns (i.e., independent sets converted into
729
+ variables).
730
+ These last steps are repeated until no column
731
+ is generated by the PSP. Finally, the final RMP is solved
732
+ with all generated variables (i.e. independent sets) with the
733
+ integrality constraints (7), as previously discussed.
734
+ A.
735
+ Worked example
736
+ Table I shows a worked example of applying the column
737
+ generation framework on the graph represented in the Fig. 4,
738
+ where the RMP is solved classically by an IP solver. The
739
+ first column shows how many PSPs were solved before reach-
740
+ ing the final solution. The second column depicts the inde-
741
+ 2
742
+ 3
743
+ 1
744
+ 4
745
+ 5
746
+ FIG. 4: Illustration of a graph with 5 vertices and 3 edges;
747
+ the set S of all independent sets is composed by the five
748
+ singletons and the sub-sets [1,2], [1,4], [2,3], [2,4], [2,5], [3,5],
749
+ [4,5], [1,2,4], [2,3,5], [2,4,5].
750
+ pendent sets selected as the solution for the RMP formula-
751
+ tion (9)-(11). The third column presents the dual solution
752
+ given by the variables w (see the dual formulation (12)-(14)).
753
+ Finally, the last column depicts the maximum weighted inde-
754
+ pendent sets generated after running each PSP, where the ¯w
755
+ parameters in the cost function of the formulation (15)-(17)
756
+ are set to the values of dual variables w; the generated
757
+ weighted independent set is then added to the set S′ be-
758
+ fore rerunning the RMP. The final coloring is represented by
759
+ the last solution for the RMP, where one color is given for
760
+ each selected independent set.
761
+ In this example, we generate all five singletons of the graph
762
+ as the first sub-set S′ of independent sets before solving the
763
+ first version of the RMP. As observed, only 4 more inde-
764
+ pendent sets (out of the remaining 10 to be generated) were
765
+ needed to find the best solution. Indeed, even though the
766
+ closed-loop could be stopped after iteration 4, the optimality
767
+ was only proven after the fifth iteration, when no indepen-
768
+ dent set whose total weight is greater than 1 can be gener-
769
+ ated (see the dual solution on the last row, which is used as
770
+ vertex weights). Note that the independent set generated in
771
+ the i-th iteration is likely to be selected in the solutions of
772
+ the RPM in the following iteration.
773
+ The values of the dual variables can be calculated by solv-
774
+ ing the dual formulation (12)-(14), where the cost function
775
+ is set to be equal to the solution cost of the RMP in the
776
+ same interaction. In this example, the cost function of the
777
+ dual formulation was set to be equal to 5, 3, 3, 2, and 2 in
778
+ the first, second, third, fourth, and fifth iterations. How-
779
+ ever, most commercial solvers solve the dual formulation in
780
+ parallel in order to prove the optimality of the (RMP) pri-
781
+ mal solution.
782
+ Hence, the final value of the dual variables
783
+ can then be easily provided by a built-in solver’s function
784
+ (e.g., solver.get dual()). Note, however, that only one inde-
785
+ pendent set (the most weighted one) is generated by solving
786
+ the related pricing formulation (15)-(17) and, due determin-
787
+ istic nature of this approach, the final solution is always the
788
+ same if the input (i.e., the graph and vertex weights) does
789
+ not change.
790
+ Now, let us exemplify how a quantum sampler could be
791
+ applied to solve the pricing sub-problems within the column
792
+ generation framework; Table II shows such a worked exam-
793
+ ple. As presented in the previous worked example depicted
794
+ in Table I, we consider the graph depicted in Fig. 4 initial
795
+ sub-set S′ composed only of singletons. As observed, only
796
+ three iterations are needed to find the final solution. Indeed,
797
+ sampling more independent sets on each pricing iteration can
798
+ considerably improve the performance of the column gener-
799
+ ation algorithm. In this example, 9 out of 10 possible inde-
800
+ pendent sets were generated. In fact, due to its stochastic
801
+ nature, a quantum sampler can efficiently provide multiple
802
+ sets with the same input and, hence, speed up the conver-
803
+ Iteration
804
+ RMP solution
805
+ Dual solution
806
+ MWIS
807
+ 1
808
+ [1] , [2] , [3] , [4] , [5] [1.0, 1.0, 1.0, 1.0, 1.0] [1, 2, 4]
809
+ 2
810
+ [3] , [5] , [1, 2, 4]
811
+ [1.0, 1.0, 1.0, -1.0, 1.0] [2, 3, 5]
812
+ 3
813
+ [3] , [5] , [1, 2, 4]
814
+ [1.0, -1.0, 1.0, 1.0, 1.0]
815
+ [1, 4]
816
+ 4
817
+ [1, 4] , [2, 3, 5]
818
+ [1.0, -1.0, 1.0, 0.0, 1.0]
819
+ [3, 5]
820
+ 5
821
+ [3, 5], [1, 2, 4]
822
+ [1.0, 0.0, 1.0, 0.0, 0.0]
823
+ None
824
+ TABLE I: A worked example of applying the column gen-
825
+ eration framework on the graph represented in the Fig. 4.
826
+ Only 5 independent sets (out of 10) are generated to find
827
+ the optimal solution.
828
+
829
+ 7
830
+ Iteration RMP solution
831
+ Dual solution
832
+ IS generated
833
+ 1
834
+ [1],[2],[3],[4],[5]
835
+ [1.0, 1.0, 1.0, 1.0, 1.0] [1, 2, 4],[2, 4, 5]
836
+ [2, 3, 5] , [1, 2]
837
+ [2, 5] , [2, 3]
838
+ [4, 5] , [3, 5]
839
+ 2
840
+ [3, 5], [1, 2, 4]
841
+ [1.0, -0.5, 1.0, 0.5, 0.0]
842
+ [1, 4]
843
+ 3
844
+ [1, 4],[2, 3, 5]
845
+ [1.0, 0.0, 1.0, 0.0, 0.0]
846
+ None
847
+ TABLE II: A worked example of applying a quantum sam-
848
+ pler to solve the pricing sub-problems related to the column
849
+ generation framework. Considering the graph represented in
850
+ the Fig. 4, only 3 different pricing sub-problems were solved
851
+ before reaching the final solution.
852
+ gence of the RMP to the optimal solution.
853
+ In what follows, we present how neutral atom-based sys-
854
+ tems can be designed to take into consideration the dual val-
855
+ ues from the RMP to output multiple weighted independent
856
+ sets and efficiently solve the related PSPs.
857
+ B.
858
+ Embedding strategy
859
+ Embedding random graphs into UD-disk representations
860
+ is proven to be an NP-hard problem [41]. Also, not all graphs
861
+ have such a realization. For instance, it is not possible to find
862
+ a UD-disk representation for any K1n star graph with n > 6
863
+ on a 2-dimension plane. In order to design a near-optimal
864
+ register to represent any graph given as an input, we use
865
+ the embedding strategy presented in [3], where an algorithm
866
+ based on force-directed principles is used to embed graphs
867
+ into planes in such a way that two connected (resp. dis-
868
+ joint) vertices are placed close to (resp. far from) each other,
869
+ with a minimum (resp. maximum) distance between them
870
+ (resp. from the plane’s center). See Appendix B for more
871
+ details.
872
+ Once the initial register is created as previously discussed,
873
+ it has the same number of atoms as the number of vertices
874
+ on the initial graph G.
875
+ However, solving the pricing sub-
876
+ problem within the column generation framework might po-
877
+ tentially imply finding one or more independent sets on a
878
+ sub-graph G′: this sub-graph is generated with only the ver-
879
+ tices with positive weight (i.e., the positive dual value pro-
880
+ vided by the solved restricted master problem). The light
881
+ pattern holding the atoms in place is created via a spatial
882
+ light modulator, and determining the right settings for this
883
+ device demands lengthy calibrations [20].
884
+ Therefore,
885
+ creating
886
+ a
887
+ new
888
+ register
889
+ by
890
+ running
891
+ the
892
+ Algorithm1 Vertex-atom remapping
893
+ Input: A graph G′, a register R and vertex weights W.
894
+ Output: The reduced register R.
895
+ 1: Let ¯V′ be the list of vertices from G′ sorted in descending order by
896
+ the weight given by W
897
+ 2: Remove all vertices whose weights are less than or equal to zero
898
+ from ¯V′
899
+ 3: Map vertex ¯V′.first to the furthest position from the center of R
900
+ 4: ¯V′ ← ¯V′\¯V′.first
901
+ 5: while ¯V′ has vertices’ do
902
+ 6:
903
+ Map vertex ¯V′.first to the furthest position from all vertices
904
+ already mapped to an atom in R
905
+ 7:
906
+ ¯V′ ← ¯V′\¯V′.first
907
+ 8: end while
908
+ 9: Remove all atoms not mapped to any vertex from register R
909
+ 10: return register R
910
+ (a) Sub-graph G′.
911
+ (b) Initial register.
912
+ (c) Vertex-atom mapping.
913
+ (d) Final register.
914
+ FIG. 5: Vertex-atom mapping for a 5-vertex graph on a 9-
915
+ atom register. Fig. 5a presents a graph with 5 vertices, whose
916
+ weights are to their indexes (e.g., the weight of vertex 1
917
+ (resp. 5) is equal to 1 (resp. 5)). Fig. 5b shows a register
918
+ with 9 atoms in their positions. Fig. 5c depicts a mapping
919
+ where the most weighted vertices are far from each other.
920
+ Finally, Fig. 5d presents the final register and the vertices
921
+ from the sub-graph they represent.
922
+ Fruchterman-Reingold algorithm with the remaining vertices
923
+ would be too time-consuming. Instead of just removing the
924
+ atoms mapped to the vertices that are no longer in the sub-
925
+ graph G′, we propose here a vertex-atom remapping strategy
926
+ that takes into consideration the vertices’ weights (dual val-
927
+ ues).
928
+ Algorithm 1 summarizes the main idea of our proposed
929
+ approach: it receives a sub-graph G′ = (V′, E′), a register R
930
+ composed of atoms and their positions within the QPU, and
931
+ vector W representing the weights for all vertices in V′. First,
932
+ let ¯V′ be the list of vertices of G′ sorted in descending or-
933
+ der by the weight given by W. Then, remove all vertices
934
+ whose weights are less than or equal to zero from ¯V′ (step 2),
935
+ map the most weighted vertex to the further atom from the
936
+ register’s center (step 3), and remove the remapped vertex
937
+ from ¯V′ (step 4). Then, the most weighted vertex in ¯V′ is
938
+ embedded into the furthest atom position from all atoms al-
939
+ ready mapped to a vertex in G′, and removed from ¯V′; these
940
+ steps are done until all vertices from G′ are mapped to an
941
+ atom in the register R. Finally, as seen in step 9, all atoms
942
+ not mapped to any vertex are removed from R. Let us re-
943
+ call that, since the proposed remapping strategy is applied
944
+ to solve the PSPs, the weight vector W is generated with
945
+ dual values provided by the solution of the current RMP,
946
+ as previously mentioned. A worked example of applying the
947
+ proposed algorithm is depicted in Fig. 5.
948
+ C.
949
+ Independent set quantum sampler
950
+ We propose an independent set sampler based on neutral
951
+ atoms, which is inspired by the quantum adiabatic approach
952
+ described by [42]. In the latter, the main idea is to slowly
953
+ evolve the system from an easy-to-prepare ground state to
954
+ the ground state of the final cost Hamiltonian HC. By slowly
955
+ evolving the system, the atoms stay in the instantaneous
956
+ ground state [43]. Here, we only aim at keeping the system
957
+ close to the instantaneous ground state, allowing it to pick
958
+ up components in the low-lying states.
959
+ In order to do such evolution, we continuously vary the
960
+ detuning δ(t) and the Rabi frequency Ω(t) in time, starting
961
+ with Ω(t0) = 0, δ(t0) < 0 and ending with Ω(tf) = 0 ,
962
+
963
+ 3
964
+ 5
965
+ 2
966
+ 42
967
+ 4
968
+ 3
969
+ 54
970
+ 2
971
+ 3
972
+ 58
973
+ δ(tf) > 0. Hence, the initial ground-state of H(t0) is |00000
974
+
975
+ ,
976
+ while the low-energy space of H(tf) contains that of the cost
977
+ Hamiltonian HC. This protocol originally aims at preparing
978
+ the ground-state and solving the MIS problem. In this work,
979
+ we use it to sample independent sets whose total weight is
980
+ equal or close to that of the MWIS.
981
+ To ensure that we are not exciting the system to states
982
+ that do not form independent sets, we have to estimate the
983
+ minimal distance between atoms that are disjoint in the
984
+ graph (this yields Ωd), and estimate the furthest distance
985
+ between two connected atoms, which gives Ωc. For this pur-
986
+ pose, let duv be the distance between nodes u and v from V,
987
+ while C6 is the interaction coefficient related to the quan-
988
+ tum device.
989
+ Then, Ωd and Ωc are respectively defined as
990
+ following:
991
+ Ωd = argmax
992
+ (u,v)/∈E
993
+ C6d−6
994
+ uv
995
+ (19)
996
+ Ωc = argmin
997
+ (u,v)∈E
998
+ C6d−6
999
+ uv
1000
+ (20)
1001
+ In unit-disk (UD) graphs, keeping Ω ∈ [Ωd, Ωc] ensures
1002
+ that only independent sets appear in the dynamics (provided
1003
+ that the dynamics is not too fast) [38, 44]. A large value of
1004
+ Ω is desirable to speed up the dynamics of the system and
1005
+ reach states that are far from the initial state. That is why
1006
+ we set Ωmax = max(Ωc, Ωd) as the maximum value the Rabi
1007
+ frequency can take during the pulse sequence.
1008
+ In the case of non-UD graphs, this value of Ωmax is still
1009
+ a good compromise. Indeed, if Ω < Ωc then the effective
1010
+ graph G′ that is encoded in the system contains more edges
1011
+ than the target graph G. The independent sets of G′ are then
1012
+ not strictly included in the independent sets of G, and the
1013
+ pricing may then miss some variables. On the other hand,
1014
+ if Ω > Ωd, all edges of G′ are also edges of G, and therefore,
1015
+ the independent sets of G′ are strictly included in the inde-
1016
+ pendent sets of G. This ensures that the pricing is still able
1017
+ to explore all independent sets and therefore provide new
1018
+ variables to improve the current solution of the RMP.
1019
+ As inputs, the quantum sampler gets an atom register and
1020
+ the pulse representing the designed Hamiltonian. Then, af-
1021
+ ter running the proposed neutral atom-based quantum algo-
1022
+ rithm, different outputs are possible:
1023
+ 1. Return only the largest independent set;
1024
+ 2. Return all independent sets;
1025
+ 3. Return all independent sets whose weights are greater
1026
+ than a given threshold;
1027
+ 4. Return only the most weighted independent set;
1028
+ For applying the two last strategies, one must also provide
1029
+ a weight vector and a cost function as inputs to the quantum
1030
+ sampler. In this work, we apply the third output case men-
1031
+ tioned above by applying the cost function (15) to qualify
1032
+ any independent set; note that for unweighted graphs, this
1033
+ cost function can be applied by setting all weights to 1.
1034
+ D.
1035
+ Solving the Pricing sub-problems
1036
+ Let ¯w be the vector of dual values related to the solved
1037
+ relaxed RMP as previously discussed.
1038
+ Then, we generate
1039
+ the graph G′ = (V′, E′, ¯w) in such a way that V′ = {u ∈
1040
+ V| ¯wu > 0} and E′ = {(u, v) ∈ E| ¯wu ¯wv > 0}. Also, for each
1041
+ vertex u ∈ V′, the related weight is given by ¯wu ∈ ¯w.
1042
+ We run the quantum algorithm previously described on
1043
+ the related graph G′ = (V′, E′, ¯w), where ¯w is the dual vec-
1044
+ tor from the current solve solution for the primal problem.
1045
+ While we keep only the atoms related to the vertices in V′,
1046
+ their positions might potentially be permuted as described
1047
+ in Algorithm 1. Also, the pulse shape might be adjusted to
1048
+ the new register by calculating the new Ωmax, which is done
1049
+ by calculating the distance between each pair of qubits, as
1050
+ previously proposed. By applying the objective function (15)
1051
+ to qualify each bitstring sampled by the QPU, the S′ is then
1052
+ updated with all sampled weighted independent sets whose
1053
+ total weight is strictly greater than 1. Let us recall that the ¯w
1054
+ might potentially be a vector composed of very small values
1055
+ (i.e., ¯wu ≪ 1, ∀u ∈ V′, including zero and negative values),
1056
+ meaning that any independent set, including the maximum
1057
+ one, might have a total weight strictly lower than 1: in this
1058
+ case, no independent set is added to S′.
1059
+ E.
1060
+ Stopping criterion
1061
+ The algorithm stops the inner loop when no column is
1062
+ generated after solving the related pricing sub-problem. This
1063
+ means that either the current sub-set S′ is already composed
1064
+ of all independent sets needed to find the optimal for the
1065
+ relaxed formulation (9)-(11) (if the PSP is exactly solved), or
1066
+ the PSP solver does not find any solution under the imposed
1067
+ constraints (if the PSP is solved heuristically).
1068
+ Once the
1069
+ inner loop stops, the ILP version of the final RMP is solved
1070
+ with all generated columns (i.e., variables/independent sets)
1071
+ and the integrality constraints (7).
1072
+ It is important to notice that the final solution given by
1073
+ the related LP formulation (9)-(11) might not be the same
1074
+ (or even the optimal one) for the ILP formulation (5)-(7)
1075
+ (i.e., with the integrality constraints (7)).
1076
+ To ensure op-
1077
+ timality, the proposed Hybrid Column Generation should
1078
+ be embedded into a Branch-and-Price framework. This ap-
1079
+ proach, however, is out of the scope of this work. For more
1080
+ information, one may refer to [1].
1081
+ VI.
1082
+ NUMERICAL SIMULATIONS
1083
+ Let us first describe the setup used in our numerical sim-
1084
+ ulations.
1085
+ While random graph instances were generated
1086
+ with the Vladimir-Brandes algorithm [45], which produces
1087
+ Erd˝os–R´enyi graphs, UD-guaranteed graphs were produced
1088
+ as proposed in [46]. It is worthwhile to mention that random
1089
+ graphs are unlikely to be unit-disks. Indeed, the probabil-
1090
+ ity of having a UD Erd˝os–R´enyi graph quickly approaches
1091
+ zero as the number of the vertices increases and the den-
1092
+ sity remains stable. For this reason, this graph class (i.e.,
1093
+ random graphs) is hereafter referred to as non-UD graphs.
1094
+ For each graph class, we generated 30 instances for three
1095
+ different graph densities by setting the probability p of con-
1096
+ necting any pair of vertices with an edge to 20%, 50%, and
1097
+ 80%. Also, the optimal solution of each instance was found
1098
+ by exactly solving the compact formulation of the Minimum
1099
+ Vertex Coloring problem [47].
1100
+ We compare our proposed hybrid algorithm to several
1101
+ state-of-the-art approaches, both classical and quantum. In-
1102
+ deed, it is possible to solve the pricing problem (15)-(17)
1103
+
1104
+ 9
1105
+ 4
1106
+ 6
1107
+ 8
1108
+ 10
1109
+ 12
1110
+ 14
1111
+ number of vertices
1112
+ 2.0
1113
+ 2.2
1114
+ 2.4
1115
+ 2.6
1116
+ 2.8
1117
+ 3.0
1118
+ 3.2
1119
+ 3.4
1120
+ number of iterations
1121
+ Strategy
1122
+ AR
1123
+ AIPR
1124
+ AR-HRD
1125
+ AIPR-HRD
1126
+ (a) 0.2-density,UD graphs.
1127
+ 4
1128
+ 6
1129
+ 8
1130
+ 10
1131
+ 12
1132
+ 14
1133
+ number of vertices
1134
+ 2.0
1135
+ 2.2
1136
+ 2.4
1137
+ 2.6
1138
+ 2.8
1139
+ number of iterations
1140
+ (b) 0.5-density,UD graphs.
1141
+ 4
1142
+ 6
1143
+ 8
1144
+ 10
1145
+ 12
1146
+ 14
1147
+ number of vertices
1148
+ 2.0
1149
+ 2.1
1150
+ 2.2
1151
+ 2.3
1152
+ 2.4
1153
+ 2.5
1154
+ 2.6
1155
+ number of iterations
1156
+ (c) 0.8-density,UD graphs.
1157
+ 4
1158
+ 6
1159
+ 8
1160
+ 10
1161
+ 12
1162
+ 14
1163
+ number of vertices
1164
+ 2.0
1165
+ 2.5
1166
+ 3.0
1167
+ 3.5
1168
+ 4.0
1169
+ 4.5
1170
+ 5.0
1171
+ number of iterations
1172
+ (d) 0.2-density, non-UD graphs.
1173
+ 4
1174
+ 6
1175
+ 8
1176
+ 10
1177
+ 12
1178
+ 14
1179
+ number of vertices
1180
+ 2
1181
+ 3
1182
+ 4
1183
+ 5
1184
+ 6
1185
+ number of iterations
1186
+ (e) 0.5-density, non-UD graphs.
1187
+ 4
1188
+ 6
1189
+ 8
1190
+ 10
1191
+ 12
1192
+ 14
1193
+ number of vertices
1194
+ 2.0
1195
+ 2.2
1196
+ 2.4
1197
+ 2.6
1198
+ 2.8
1199
+ 3.0
1200
+ 3.2
1201
+ 3.4
1202
+ 3.6
1203
+ number of iterations
1204
+ (f) 0.8-density, non-UD graphs.
1205
+ FIG. 6: Number of iterations on the QPU emulator before reaching the stop criteria on different graph classes (UD and
1206
+ non-UD), orders (from 4 up to 14 vertices), and densities (20%, 50%, and 80% of all possible connections) and applying
1207
+ different register and Hamiltonian redesign strategies: only atom removal (AR), atom index permutation and atom removal
1208
+ (AIPR), atom removal with Hamiltonian redesign (AR-HDR), and AIPR with Hamiltonian redesign (AIPR-HDR).
1209
+ with a classical solver, where G′ is given as a vertex-weighted
1210
+ graph. Note, however, that only the optimal weighted inde-
1211
+ pendent set is generated on each iteration. As previously
1212
+ discussed, due deterministic nature of this approach, here-
1213
+ after referred to as Classical CG, the final solution does not
1214
+ change same if the input (i.e., the graph and vertex weights)
1215
+ remains the same. We also compared our proposed approach
1216
+ to the Classical Greedy algorithm described in Appendix A,
1217
+ where a maximum independent set was provided by a classi-
1218
+ cal solver on each iteration. We use GLPK [48] as the linear
1219
+ solver to solve the (reduced) master problem and classical
1220
+ pricing sub-problems.
1221
+ In order to compare our neutral atom-based quantum
1222
+ sampler to other stochastic approaches, we implemented a
1223
+ greedy generator, hereafter referred to as Greedy CG, that
1224
+ can randomly generate multiple weighted independent sets.
1225
+ For more details, see Appendix C. We also compared our
1226
+ approach to a simulated annealing (SA)-based solver, here-
1227
+ after referred to as SA CG, where we minimize the related
1228
+ maximum weighted independent set QUBO matrix described
1229
+ in (4) with the classical D-Wave QUBO sampler [49]; the
1230
+ weights are given by the dual values of the solved RMP on
1231
+ each iteration, while α is set to the sum of absolute values
1232
+ of weights.
1233
+ For all stochastic sub-routines, the maximum
1234
+ number of tries was set to 1000. Moreover, several pricing
1235
+ iterations can be done before getting an improvement on the
1236
+ RPM solution. This is due to the inherent symmetry of the
1237
+ solution space related to the instance of the problem, driv-
1238
+ ing the algorithm to generate independent sets with the same
1239
+ cost. In all CG-based approaches, the maximum number of
1240
+ pricing iterations allowed without any improvements in the
1241
+ RMP solution was set to 3. Finally, we also compared our
1242
+ hybrid approach against a quantum version of the greedy
1243
+ algorithm described in Appendix A, where only the largest
1244
+ independent set sampled by the proposed quantum sampler
1245
+ described in section V C is returned on each iteration. This
1246
+ approach is hereafter referred to as Quantum Greedy and is
1247
+ based on the work proposed by Vitali et al [36].
1248
+ The register related to each pricing sub-problem was cre-
1249
+ ated by applying the embedding strategy presented in Sec-
1250
+ tion V B. To this end, each atom’s position was found with
1251
+ the spring layout function from Networkx package [50]: we
1252
+ multiplied each position vector by 40 in order to respect the
1253
+ distance constraints imposed by the device. Moreover, we
1254
+ applied the Hamiltonian design strategy described in section
1255
+ V C.
1256
+ The evolution of the quantum system under the predicted
1257
+ pulse for a given register was then simulated using Pulser’s
1258
+ simulation module [51].
1259
+ Both noiseless and noisy simula-
1260
+ tions were performed. Noiseless simulations involve solving
1261
+ the time-dependent Schr¨odinger equation. The output of a
1262
+ noiseless simulation is a vector in the Hilbert space that can
1263
+ be sampled a finite number of times in order to mimic a real
1264
+ experimental setup with a limited measurement budget. In
1265
+ order to assess the robustness of our approach against noise,
1266
+ noisy simulations were also performed. These calculations
1267
+ are numerically expensive and we restrict our study to State
1268
+ Preparation And Measurement (SPAM) errors. These are
1269
+ expected to be the main source of noise and can be obtained
1270
+ by post-processing of noiseless results (for more details, see
1271
+ [39]). We set here the noise parameters to realistic values
1272
+ based on current hardware specifications.
1273
+ They are sum-
1274
+ SPAM
1275
+ bad preparation η
1276
+ 0.005
1277
+ false positive ϵ
1278
+ 0.03
1279
+ false negative ϵ′
1280
+ 0.08
1281
+ Temperature
1282
+ 30µK
1283
+ Laser waist
1284
+ 148µm
1285
+ TABLE III: Noise parameters used in noisy emulations.
1286
+
1287
+ 10
1288
+ 4
1289
+ 6
1290
+ 8
1291
+ 10
1292
+ 12
1293
+ 14
1294
+ number of vertices
1295
+ 2
1296
+ 4
1297
+ 6
1298
+ 8
1299
+ 10
1300
+ number of iterations
1301
+ Approach
1302
+ Classical CG
1303
+ Classical Greedy
1304
+ Quantum Greedy
1305
+ Greedy CG
1306
+ SA CG
1307
+ Noiseless Quantum CG
1308
+ (a) 0.2-density, UD graphs.
1309
+ 4
1310
+ 6
1311
+ 8
1312
+ 10
1313
+ 12
1314
+ 14
1315
+ number of vertices
1316
+ 2
1317
+ 4
1318
+ 6
1319
+ 8
1320
+ 10
1321
+ 12
1322
+ number of iterations
1323
+ (b) 0.5-density, UD graphs.
1324
+ 4
1325
+ 6
1326
+ 8
1327
+ 10
1328
+ 12
1329
+ 14
1330
+ number of vertices
1331
+ 2
1332
+ 4
1333
+ 6
1334
+ 8
1335
+ 10
1336
+ number of iterations
1337
+ (c) 0.8-density, UD graphs.
1338
+ 4
1339
+ 6
1340
+ 8
1341
+ 10
1342
+ 12
1343
+ 14
1344
+ number of vertices
1345
+ 2
1346
+ 4
1347
+ 6
1348
+ 8
1349
+ 10
1350
+ number of iterations
1351
+ (d) 0.2-density, non-UD graphs.
1352
+ 4
1353
+ 6
1354
+ 8
1355
+ 10
1356
+ 12
1357
+ 14
1358
+ number of vertices
1359
+ 2
1360
+ 4
1361
+ 6
1362
+ 8
1363
+ 10
1364
+ 12
1365
+ number of iterations
1366
+ (e) 0.5-density, non-UD graphs.
1367
+ 4
1368
+ 6
1369
+ 8
1370
+ 10
1371
+ 12
1372
+ 14
1373
+ number of vertices
1374
+ 2
1375
+ 4
1376
+ 6
1377
+ 8
1378
+ 10
1379
+ 12
1380
+ number of iterations
1381
+ (f) 0.8-density, non-UD graphs.
1382
+ FIG. 7: Number of iterations before reaching the stop criteria on different graph classes (UD and non-UD), orders (from 4
1383
+ up to 14 vertices), and densities (20%, 50%, and 80% of all possible connections) by applying different approaches: Classical
1384
+ Column Generation (CG), Greedy CG, SA CG, Quantum CG, Classical Greedy, and Quantum Greedy.
1385
+ marized in Table III. The register and Hamiltonian design
1386
+ were done as previously presented in sections V B and V C,
1387
+ respectively.
1388
+ A.
1389
+ Register and pulse redesign strategies
1390
+ We first analyze the impact of four different registers and
1391
+ pulse (i.e., Hamiltonian) redesign strategies on the perfor-
1392
+ mance of our proposed hybrid classical-quantum column gen-
1393
+ eration approach: while the Atom Removal (AR) strategy
1394
+ only removes the atoms whose related vertex’s weight is
1395
+ equal to or less than zero, Atom Index Permutation and
1396
+ Atom Removal (AIPR) strategy also apply the proposed
1397
+ vertex-atom remapping algorithm (see Algorithm 1). In ad-
1398
+ dition to these two strategies, we tested the Atom Removal
1399
+ with Hamiltonian Redesign (AR-HDR), in which the new
1400
+ maximal Rabi frequency is recalculated after applying the
1401
+ AR strategy.
1402
+ Finally, in Atom Index Permutation, Atom
1403
+ Removal and Hamiltonian Redesign (AIPR-HDR) strategy,
1404
+ the new maximal Rabi frequency can also be recalculated
1405
+ after applying the AIPR strategy.
1406
+ Fig. 6 shows the average number of pricing iterations (and
1407
+ the standard deviation with 95% confidence interval) before
1408
+ reaching the stop criteria on different graph classes (UD and
1409
+ non-UD), order (from 4 up to 14 vertices), and densities
1410
+ (20%, 50%, and 80% of all possible connections).
1411
+ As ob-
1412
+ served, only a few calls to the quantum sampler (i.e., pricing
1413
+ iterations) were needed to reach the best solution of the re-
1414
+ laxed version2 of the master problem related to each graph
1415
+ 2 Let us recall that the dual variables can be only generated from linear
1416
+ programs, meaning that the integrality constraints (7) are replaced
1417
+ by constraints (11).
1418
+ instance. Indeed, the average number of iterations on non-
1419
+ UD (resp. UD) graphs was always less than 6 (resp. 3); as
1420
+ seen in Fig. 6c (resp. Fig. 6f), only 2 (resp. 3) sampling pro-
1421
+ cesses were done in average to solve UD (resp. non-UD)
1422
+ graphs with 4 (resp. 13) vertices and 80% density when
1423
+ AIRP (resp. AR-HDR) strategy was applied. Even though
1424
+ non-UD graphs seem to be more difficult to be solved, es-
1425
+ pecially those with 50% of density (see Fig. 6e), applying
1426
+ different register and pulse redesign strategies could speed
1427
+ up the solving process. While we do not observe any signif-
1428
+ icant impact from redesigning the pulse after only removing
1429
+ useless atoms from the register (see blue and green lines re-
1430
+ spectively related to AR and AR-HDR strategies), recalcu-
1431
+ lating the maximum value of the Rabi frequency after per-
1432
+ muting atoms’ indices (i.e., applying AIPR-HDR approach)
1433
+ could decrease the number of sampling processes by 44% (see
1434
+ Fig. 6d). Indeed, as seen in Figures 6a and 6d, this approach
1435
+ had the best overall performance, having a stronger impact
1436
+ on sparse graphs.
1437
+ B.
1438
+ Quantum and classical approaches
1439
+ We now compare the number of iterations needed to be
1440
+ run on different graph classes, orders, and densities by ap-
1441
+ plying different approaches: Classical Column Generation
1442
+ (CG), Greedy CG, SA CG, Noiseless Quantum CG, Classical
1443
+ Greedy, and Quantum Greedy. We applied the AIPR-HDR
1444
+ strategy for redesigning each pricing sub-problem within the
1445
+ Quantum CG framework.
1446
+ While this indicator refers to
1447
+ how many times the PSP was solved within both classical
1448
+ and quantum column generation frameworks for coloring a
1449
+ given graph, it indicates how many independent sets were
1450
+ generated during the while-loop on Algorithm 2 by using
1451
+ both classical and quantum methods as previously discussed.
1452
+ Fig. 7 shows the average number of iterations and the stan-
1453
+
1454
+ 11
1455
+ 4
1456
+ 6
1457
+ 8
1458
+ 10
1459
+ 12
1460
+ 14
1461
+ number of vertices
1462
+ 0.0
1463
+ 0.2
1464
+ 0.4
1465
+ 0.6
1466
+ 0.8
1467
+ 1.0
1468
+ gap
1469
+ Approach
1470
+ Classical CG
1471
+ Classical Greedy
1472
+ Quantum Greedy
1473
+ Greedy CG
1474
+ SA CG
1475
+ Noiseless Quantum CG
1476
+ (a) 0.2-density, UD graphs.
1477
+ 4
1478
+ 6
1479
+ 8
1480
+ 10
1481
+ 12
1482
+ 14
1483
+ number of vertices
1484
+ 0.00
1485
+ 0.05
1486
+ 0.10
1487
+ 0.15
1488
+ 0.20
1489
+ 0.25
1490
+ gap
1491
+ (b) 0.5-density, UD graphs.
1492
+ 4
1493
+ 6
1494
+ 8
1495
+ 10
1496
+ 12
1497
+ 14
1498
+ number of vertices
1499
+ 0.00
1500
+ 0.01
1501
+ 0.02
1502
+ 0.03
1503
+ 0.04
1504
+ 0.05
1505
+ 0.06
1506
+ gap
1507
+ (c) 0.8-density, UD graphs.
1508
+ 4
1509
+ 6
1510
+ 8
1511
+ 10
1512
+ 12
1513
+ 14
1514
+ number of vertices
1515
+ 0.0
1516
+ 0.2
1517
+ 0.4
1518
+ 0.6
1519
+ 0.8
1520
+ 1.0
1521
+ 1.2
1522
+ gap
1523
+ (d) 0.2-density, non-UD graphs.
1524
+ 4
1525
+ 6
1526
+ 8
1527
+ 10
1528
+ 12
1529
+ 14
1530
+ number of vertices
1531
+ 0.00
1532
+ 0.05
1533
+ 0.10
1534
+ 0.15
1535
+ 0.20
1536
+ 0.25
1537
+ gap
1538
+ (e) 0.5-density, non-UD graphs.
1539
+ 4
1540
+ 6
1541
+ 8
1542
+ 10
1543
+ 12
1544
+ 14
1545
+ number of vertices
1546
+ 0.00
1547
+ 0.02
1548
+ 0.04
1549
+ 0.06
1550
+ 0.08
1551
+ 0.10
1552
+ 0.12
1553
+ 0.14
1554
+ 0.16
1555
+ gap
1556
+ (f) 0.8-density, non-UD graphs.
1557
+ FIG. 8: Gab between the best solution found and the optimal one on different graph classes (UD and non-UD), orders
1558
+ (from 4 up to 14 vertices), and densities (20%, 50%, and 80% of all possible connections) by applying different approaches:
1559
+ Classical Column Generation (CG), Greedy CG, SA CG, Noiseless Quantum CG, Classical Greedy, and Quantum Greedy.
1560
+ dard deviation (with 95% confidence interval) on 30 graphs
1561
+ randomly generated as presented above.
1562
+ First, we observe that the Quantum Greedy approach has
1563
+ the same overall performance as its classical counterpart,
1564
+ showing that our quantum sampler can solve the Maximum
1565
+ Independent Set problem efficiently. Also, both strategies
1566
+ have the same linear behavior related to the size of the graph,
1567
+ i.e., the number of edges it contains, being most impacted
1568
+ by dense graphs (see Figures 7c and 7f). This behavior is
1569
+ expected since the size of each independent set gets smaller
1570
+ as the set of edges gets larger. Hence, more iterations have,
1571
+ in general, to be done to cover all vertices of a dense graph.
1572
+ Also, while outperforming the Classical CG approach on al-
1573
+ most every graph class (in terms of the number of iterations),
1574
+ both Classical and Quantum Greedy algorithms had their
1575
+ performance slightly decreased on UD graphs. Finally, tak-
1576
+ ing advantage of the related superposition aspect, the pro-
1577
+ posed Quantum CG outperformed all other approaches on
1578
+ all graph classes. For instance, while the Quantum CG algo-
1579
+ rithm needed less than 4 (resp. 6) sampling iterations for all
1580
+ sparse and dense (resp. 0.5-density) non-UD graphs, Quan-
1581
+ tum and Classical Greedy approaches (resp. Classical CG
1582
+ algorithm) needed up to 10 (resp. 12) pricing interactions to
1583
+ solve the same graph class.
1584
+ Fig. 8 shows the average gap (and the standard devia-
1585
+ tion with 95% of confidence interval) between the optimal
1586
+ solution and the best one found by applying the presented
1587
+ approaches. First, we observe that our proposed Quantum
1588
+ CG approach has the best overall performance. Indeed, it
1589
+ could find the optimal solution in almost all instances; as
1590
+ seen in Fig. 8f, our approach could not find the best solu-
1591
+ tion only for some 13-vertex non-UD graphs. Also, unlike
1592
+ all other approaches, the Quantum CG is not impacted by
1593
+ the graph class; while the Classical CG could better perform
1594
+ on dense graphs (see Figures 8c and 8f), both Classical and
1595
+ Quantum Greedy approaches are more stable on UD graphs.
1596
+ Also, as depicted in Fig. 8d (resp. Fig. 8a), the proposed
1597
+ Quantum CG algorithm could reduce the average gap on 12-
1598
+ vertex non-UD (resp. 13-vertex UD) graphs from roughly
1599
+ 19% (resp.
1600
+ 11%) to 0% when compared to the Quantum
1601
+ Greedy (resp. Classical CG) approach.
1602
+ Our proposed quantum pricing-based approach also out-
1603
+ performed both stochastic classical approaches in most of the
1604
+ instances, especially those related to UD and sparse graphs.
1605
+ Even though the quality of the solutions remains the same
1606
+ (see Fig. 8), the Noiseless Quantum CG could reduce by 50%
1607
+ the number of iterations on sparse graphs when compared to
1608
+ SA-based pricing, as observed in Figures 7a and 7d). Even
1609
+ though the Greedy CG has fewer pricing iterations on some
1610
+ graph classes, as in bigger non-UD graphs with 20% and 50%
1611
+ of density (see Figures 7d and 7e), the average gap could be
1612
+ reduced by 80% when our proposed Quantum CG was ap-
1613
+ plied on the same graph classes, as we observe in Figures 8a
1614
+ and 8d. This indicates that random sampling to find inde-
1615
+ pendent sets cannot solve pricing sub-problems effectively.
1616
+ C.
1617
+ Noisy and noiseless simulations
1618
+ We now present the results from our numerical simula-
1619
+ tions wherein emulated noise was added as previously dis-
1620
+ cussed. Fig. 9 depicts the number of iterations before reach-
1621
+ ing the stop criteria and the gap between the final solu-
1622
+ tion and the optimal one on different graph orders (from
1623
+ 4 up to 14 vertices) by applying different approaches: Clas-
1624
+ sical CG, Greedy CG, SA CG, Noiseless Quantum CG, and
1625
+ Noisy Quantum CG. The results shown are related to ap-
1626
+ plying a given approach on all graph instances of the same
1627
+ order, regardless of their density and whether they are unit
1628
+ disks. First, as seen in Fig. 9a, no impact was observed when
1629
+ noise is added to the quantum independent set sampler. In-
1630
+ deed, the overall final gap was similar to the noiseless model,
1631
+
1632
+ 12
1633
+ 4
1634
+ 6
1635
+ 8
1636
+ 10
1637
+ 12
1638
+ 14
1639
+ number of vertices
1640
+ 0.0
1641
+ 0.1
1642
+ 0.2
1643
+ 0.3
1644
+ 0.4
1645
+ gap
1646
+ (a) Gab between the final solution and the optimal one.
1647
+ 4
1648
+ 6
1649
+ 8
1650
+ 10
1651
+ 12
1652
+ 14
1653
+ number of vertices
1654
+ 2
1655
+ 4
1656
+ 6
1657
+ 8
1658
+ 10
1659
+ number of iterations
1660
+ Approach
1661
+ Classical CG
1662
+ Noisy Quantum CG
1663
+ Greedy CG
1664
+ SA CG
1665
+ Noiseless Quantum CG
1666
+ (b) Number of iterations before reaching the stop criteria.
1667
+ FIG. 9: Number of iterations before reaching the stop cri-
1668
+ teria and the gap between the final solution and the op-
1669
+ timal one on different graph orders (from 4 up to 14 ver-
1670
+ tices) applying different approaches: Classical Column Gen-
1671
+ eration (CG), Greedy CG, SA CG, Noiseless Quantum CG,
1672
+ and Noisy Quantum CG
1673
+ also outperforming the classical CG. Finally, as observed in
1674
+ Fig. 9b the number of iterations needed to find the optimal
1675
+ solution of the relaxed RMP was increased by only 6% in
1676
+ average when the noisy model is compared to the noiseless
1677
+ one, even on big graphs.
1678
+ CONCLUSION
1679
+ In this study, we demonstrated that it is possible to incor-
1680
+ porate quantum elements into classical state-of-the-art algo-
1681
+ rithms in order to improve their performances. Compared
1682
+ to the classical column generation, our neutral atom-based
1683
+ quantum pricing could reduce by up to 83% the number
1684
+ of iterations needed to solve the Minimum Vertex Color-
1685
+ ing problem. Also, our proposed hybrid approach could re-
1686
+ duce the average gap from 19% to 0% when compared to
1687
+ both classical and greedy approaches. Moreover, unlike the
1688
+ deterministic approaches, our quantum pricing-based col-
1689
+ umn generation is robust to all graph classes, including non
1690
+ unit-disk graphs of all tested orders and sizes.
1691
+ This indi-
1692
+ cates that the proposed hybrid algorithm can efficiently solve
1693
+ other combinatorial problems (e.g., Minimum Edge Color-
1694
+ ing and Minimum Clustering problems) after some trivial
1695
+ translation-based pre-processing. The proposed framework
1696
+ also outperformed other stochastic algorithms, especially on
1697
+ sparse graphs. Indeed, our quantum pricing-based column
1698
+ generation could reduce by up to 50% the number of pricing
1699
+ iterations and by up to 80% the gap of the final solution
1700
+ on graphs when compared to the simulated annealing-based
1701
+ and greedy-based pricing approaches, respectively. Finally,
1702
+ we observed that our proposed hybrid framework is robust
1703
+ to noise. Indeed, the quality of the final solutions was not
1704
+ impacted when compared to the noiseless model, which is
1705
+ a great indication of how noise-resilient the analog mode of
1706
+ operation can be. Our proposed approach can readily be im-
1707
+ plemented on neutral-atom quantum computing hardware.
1708
+ Let us recall that our proposed algorithm remains a
1709
+ heuristic approach to solving combinatorial problems. Even
1710
+ though it can provide high-quality solutions to a plurality
1711
+ of instance classes, embedding this method into a Branch-
1712
+ and-Pricing framework is necessary to guarantee optimality
1713
+ to any instance of the problem under consideration. Since
1714
+ providing the initial sub-set of variables for the reduced mas-
1715
+ ter problem is an important step in any column generation-
1716
+ based algorithm, the proposed quantum sampler can be used
1717
+ as a warm starter to generate such a subset of elements (e.g.,
1718
+ independent sets). In the case of solving the Minimal Ver-
1719
+ tex Coloring problem, by setting all vertex weights to 1, this
1720
+ approach might be useful in scenarios where QPU resources
1721
+ are limited. Also, this strategy might potentially speed up
1722
+ both classical and quantum column generation approaches.
1723
+ Moreover, an optimal control-based strategy to design pulses
1724
+ to each input instance might potentially be applied to solve
1725
+ non-trivial pricing sub-problems. Similarly, different register
1726
+ embedding approaches can be developed to take into consid-
1727
+ eration different information from the input data.
1728
+ ACKNOWLEDGMENTS
1729
+ We thank Julien Bernos and Vincent Elfving for insightful
1730
+ discussions. During the completion of this manuscript, we
1731
+ became aware of a related work [52].
1732
+ Appendix A: A Greedy algorithm for the Minimum
1733
+ Vertex Coloring problem
1734
+ We present here a greedy heuristic based on the Minimum
1735
+ Vertex Coloring framework introduced by [36]. The main
1736
+ idea relies on interactively solving the Maximum Indepen-
1737
+ dent Set problem with only a subset of the vertices of a given
1738
+ graph. Algorithm 2 summarizes the proposed approach.
1739
+ As input, the Algorithm 2 receives a graph G = (V, E)
1740
+ Algorithm2 Greedy Algorithm
1741
+ Input: A Graph G = (V, E) and a set C of available colors.
1742
+ Output: Color-vertex assignment.
1743
+ 1: G′ ← G
1744
+ 2: c ← 1
1745
+ 3: while G′ has vertices do
1746
+ 4:
1747
+ Find a (maximum) independent set IS in G′
1748
+ 5:
1749
+ Assign color c ∈ C to all vertices from IS in G
1750
+ 6:
1751
+ Remove all incident edges of each vertex in IS from G′.
1752
+ 7:
1753
+ Remove the set IS of vertices from G′.
1754
+ 8:
1755
+ c = c + 1
1756
+ 9: end while
1757
+
1758
+ 13
1759
+ and a set C of available colors. Note that, to always have
1760
+ a feasible color assignment, |V| ≤ |C| must hold. First, a
1761
+ copy of G is made with an auxiliary graph G′ ≡
1762
+ G.
1763
+ A
1764
+ variable k is also created: it keeps the index of the first
1765
+ available color.
1766
+ Then, steps 3-7 are done until no vertex
1767
+ remains in G′. On each iteration, a feasible independent set
1768
+ in G′, potentially a maximal one, is generated. For instance,
1769
+ a classical solver can be used to solve the formulation (4)
1770
+ or one may use the proposed quantum sampler described
1771
+ in section V C by setting the algorithm to output only the
1772
+ largest sampled independent set. Then, all vertices of G with
1773
+ the same indices as those in the found independent set IS
1774
+ are colored with the first available color from C, whose index
1775
+ is given by the variable c. Next, all vertices of IS (and the
1776
+ related incident edges) are removed from G′, and then the
1777
+ reference of the first available color is updated (see step 8).
1778
+ It is worth mentioning that, while the number of qubits
1779
+ needed to run this algorithm on a QPU is reduced when com-
1780
+ pared to other approaches, its performance can be strongly
1781
+ impacted by the order in which the independent sets are gen-
1782
+ erated. Also, in the worst case, |V| iterations can be done
1783
+ in the quantum device (take a complete graph as an exam-
1784
+ ple) before the final solution is found. More details about its
1785
+ performance are presented in Section VI.
1786
+ Appendix B: Force-directed algorithm
1787
+ As pointed in [3], algorithms based on force-directed prin-
1788
+ ciples are normally used to embed graphs into planes in
1789
+ such a way that two connected (resp. disjoint) vertices are
1790
+ placed close to (resp. far from) each other, with a mini-
1791
+ mum (resp. maximum) distance between them (resp. from
1792
+ the plane’s center). In this context, in order to reflect in-
1793
+ herent symmetries, Fruchterman and Reingold [53] also pro-
1794
+ pose an efficient algorithm to place the vertices evenly in the
1795
+ plane, making the edges’ lengths uniform. For this purpose,
1796
+ each edge from the graph is treated as a spring that holds
1797
+ its endpoint vertices close to each other while a competing
1798
+ repulsive force is applied to push all vertices away from one
1799
+ another, even though they are not connected by an edge in
1800
+ the original graph. After enough iterations, the final sys-
1801
+ tem will reach equilibrium, minimizing then the difference
1802
+ between all attractive and repulsive forces.
1803
+ The repulsive and attractive forces fr and fa between two
1804
+ vertices are respectively given by equations (B1) and (B2).
1805
+ While k =
1806
+
1807
+ A/|V| is set to be related to the area A of the
1808
+ Euclidean plane, duv holds the distance between the vertices
1809
+ u, v ∈ V. Finally, the total energy ft of the system is given
1810
+ by adding the forces between all pairs of vertices, as shown
1811
+ in (B3). Therefore, ft goes to zero as the system approaches
1812
+ its equilibrium. This register embedding is hereafter referred
1813
+ to as spring layout.
1814
+ fr(u, v) = −k2/ruv
1815
+ (B1)
1816
+ fa(u, v) = d2
1817
+ uv/k
1818
+ (B2)
1819
+ ft =
1820
+
1821
+ u,v∈E
1822
+ fa(u, v) +
1823
+
1824
+ u∈V
1825
+
1826
+ v∈V:u̸=v
1827
+ fr(u, v)
1828
+ (B3)
1829
+ Fig. 10 depicts a possible embedding by directly applying
1830
+ the algorithm on a graph with 5 vertices and 7 edges. For a
1831
+ deep description of the algorithm, one may refer to [3, 53].
1832
+ If such a realization exists, the graph under consideration is
1833
+ naturally embedded as a UD graph if enough iterations are
1834
+ allowed (i.e., by iterating until the system reaches the equi-
1835
+ librium). It is also worthwhile mentioning that, as pointed
1836
+ out by [3], the proposed embedding strategy is only feasible
1837
+ on neutral atom-based QPUs once they respect the device’s
1838
+ technical constraints, such as maximum distance from the
1839
+ register’s center and minimum distance between atoms. If
1840
+ any technical constraint is violated, one might re-scaling ev-
1841
+ ery position vector by a factor α > 0.
1842
+ FIG. 10: Illustration of a register based on the spring layout
1843
+ for a given graph G = (V, E) with 5 vertices and 7 edges:
1844
+ the positions were generated with the Fruchterman-Reingold
1845
+ algorithm.
1846
+ Appendix C: Classical greedy pricing algorithm
1847
+ Algorithm 3 summarizes the proposed random weighted
1848
+ independent set generator. As input, the algorithm receives
1849
+ a graph G = (V, E, W), where W is the vertex weighting vec-
1850
+ tor. First, an auxiliary graph G′ is created to receive a copy
1851
+ of the input graph G (step 3). Then, a vertex from graph
1852
+ G′ is randomly selected and added to the independent set S
1853
+ (see steps 6-7). Next, the selected vertex and its neighbors
1854
+ are removed from G′ in step 8. Steps 6-8 are repeated until
1855
+ no vertex remains. The overall cost of the final solution is
1856
+ then calculated considering the vertex weighting vector W
1857
+ (see step 11).
1858
+ Due to the inherently stochastic nature of
1859
+ the proposed algorithm, different weighted independent sets
1860
+ might potentially be generated from the same input by run-
1861
+ ning steps 3-11 can be run multiple times (see the condition
1862
+ in step 2).
1863
+ Algorithm3 Random Independent Set Generator
1864
+ Input: A Graph G = (V, E), W, a threshold weight wmin, and
1865
+ the maximum number of tries t.
1866
+ Output: A set of weighted independent sets.
1867
+ 1: S ← ∅
1868
+ 2: while The maximum number of tries t is not reached do
1869
+ 3:
1870
+ G′ ← G
1871
+ 4:
1872
+ IS ← ∅
1873
+ 5:
1874
+ while G′ has vertices do
1875
+ 6:
1876
+ Randomly select a vertex in G′
1877
+ 7:
1878
+ Add the selected vertex to IS
1879
+ 8:
1880
+ Remove the selected vertex and its neighbors from G′.
1881
+ 9:
1882
+ end while
1883
+ 10:
1884
+ if IS was not generated before and its total weight is
1885
+ greater than wmin then
1886
+ 11:
1887
+ S ← S ∪ IS
1888
+ 12:
1889
+ end if
1890
+ 13: end while
1891
+ 14: return S
1892
+
1893
+ 3
1894
+ 5
1895
+ 2
1896
+ 414
1897
+ [1] C. Barnhart, E. L. Johnson, G. L. Nemhauser, M. W. Savels-
1898
+ bergh, and P. H. Vance, “Branch-and-price: Column genera-
1899
+ tion for solving huge integer programs,” Operations research,
1900
+ vol. 46, no. 3, pp. 316–329, 1998.
1901
+ [2] A. Bachem and W. Kern, “Linear programming duality,” in
1902
+ Linear Programming Duality.
1903
+ Springer, 1992, pp. 89–111.
1904
+ [3] W.
1905
+ d.
1906
+ S.
1907
+ Coelho,
1908
+ M.
1909
+ D’Arcangelo,
1910
+ and
1911
+ L.-P.
1912
+ Henry,
1913
+ “Efficient protocol for solving combinatorial graph problems
1914
+ on
1915
+ neutral-atom
1916
+ quantum
1917
+ processors,”
1918
+ 2022.
1919
+ [Online].
1920
+ Available: https://arxiv.org/abs/2207.13030
1921
+ [4] M. Kjaergaard, M. E. Schwartz, J. Braum¨uller, P. Krantz,
1922
+ J. I.-J. Wang, S. Gustavsson, and W. D. Oliver, “Supercon-
1923
+ ducting qubits: Current state of play,” Annual Review of
1924
+ Condensed Matter Physics, vol. 11, no. 1, pp. 369–395, 2020.
1925
+ [5] M.
1926
+ H.
1927
+ Devoret,
1928
+ A.
1929
+ Wallraff,
1930
+ and
1931
+ J.
1932
+ M.
1933
+ Martinis,
1934
+ “Superconducting qubits: A short review,” 2004. [Online].
1935
+ Available: https://arxiv.org/abs/cond-mat/0411174
1936
+ [6] I. Pogorelov, T. Feldker, C. D. Marciniak, L. Postler, G. Ja-
1937
+ cob, O. Krieglsteiner, V. Podlesnic, M. Meth, V. Negnevit-
1938
+ sky, M. Stadler, B. H¨ofer, C. W¨achter, K. Lakhmanskiy,
1939
+ R. Blatt, P. Schindler, and T. Monz, “Compact ion-trap
1940
+ quantum computing demonstrator,” PRX Quantum, vol. 2,
1941
+ p. 020343, Jun 2021.
1942
+ [7] J. Benhelm, G. Kirchmair, C. F. Roos, and R. Blatt, “To-
1943
+ wards fault-tolerant quantum computing with trapped ions,”
1944
+ Nature Physics, vol. 4, no. 6, pp. 463–466, apr 2008.
1945
+ [8] C. Ant´on, J. C. Loredo, G. Coppola, H. Ollivier, N. Vig-
1946
+ gianiello, A. Harouri, N. Somaschi, A. Crespi, I. Sagnes,
1947
+ A. Lemaˆıtre, L. Lanco, R. Osellame, F. Sciarrino, and
1948
+ P. Senellart, “Interfacing scalable photonic platforms: solid-
1949
+ state based multi-photon interference in a reconfigurable
1950
+ glass chip,” Optica, vol. 6, no. 12, pp. 1471–1477, Dec 2019.
1951
+ [9] L. Henriet, L. Beguin, A. Signoles, T. Lahaye, A. Browaeys,
1952
+ G.-O. Reymond, and C. Jurczak, “Quantum computing with
1953
+ neutral atoms,” Quantum, vol. 4, p. 327, 2020.
1954
+ [10] J. Wurtz, P. Lopes, N. Gemelke, A. Keesling, and S. Wang,
1955
+ “Industry applications of neutral-atom quantum computing
1956
+ solving independent set problems,” 2022.
1957
+ [11] J. A. Bondy, U. S. R. Murty et al., Graph theory with appli-
1958
+ cations.
1959
+ Macmillan London, 1976, vol. 290.
1960
+ [12] M. Roth, A. Ben-David, D. Deutscher, G. Flysher, I. Horn,
1961
+ A. Leichtberg, N. Leiser, Y. Matias, and R. Merom, “Sug-
1962
+ gesting friends using the implicit social graph,” in Proceed-
1963
+ ings of the 16th ACM SIGKDD international conference on
1964
+ Knowledge discovery and data mining, 2010, pp. 233–242.
1965
+ [13] A. Kershenbaum, Telecommunications network design algo-
1966
+ rithms.
1967
+ McGraw-Hill, Inc., 1993.
1968
+ [14] F. Barahona, M. Gr¨otschel, M. J¨unger, and G. Reinelt,
1969
+ “An application of combinatorial optimization to statisti-
1970
+ cal physics and circuit layout design,” Operations Research,
1971
+ vol. 36, no. 3, pp. 493–513, 1988.
1972
+ [15] K. Bharti,
1973
+ A. Cervera-Lierta,
1974
+ T. H. Kyaw,
1975
+ T. Haug,
1976
+ S. Alperin-Lea, A. Anand, M. Degroote, H. Heimonen, J. S.
1977
+ Kottmann, T. Menke, W.-K. Mok, S. Sim, L.-C. Kwek, and
1978
+ A. Aspuru-Guzik, “Noisy intermediate-scale quantum algo-
1979
+ rithms,” Reviews of Modern Physics, vol. 94, no. 1, feb 2022.
1980
+ [16] H. Nishi, T. Kosugi, and Y. ichiro Matsushita, “Implementa-
1981
+ tion of quantum imaginary-time evolution method on NISQ
1982
+ devices by introducing nonlocal approximation,” npj Quan-
1983
+ tum Information, vol. 7, no. 1, jun 2021.
1984
+ [17] J. Wurtz, P. Lopes, N. Gemelke, A. Keesling, and S. Wang,
1985
+ “Industry applications of neutral-atom quantum computing
1986
+ solving independent set problems,” 2022. [Online]. Available:
1987
+ https://arxiv.org/abs/2205.08500
1988
+ [18] S. Ebadi, A. Keesling, M. Cain, T. T. Wang, H. Levine,
1989
+ D. Bluvstein, G. Semeghini, A. Omran, J.-G. Liu, R. Sama-
1990
+ jdar, X.-Z. Luo, B. Nash, X. Gao, B. Barak, E. Farhi,
1991
+ S. Sachdev, N. Gemelke, L. Zhou, S. Choi, H. Pichler, S.-
1992
+ T. Wang, M. Greiner, V. Vuleti´c , and M. D. Lukin, “Quan-
1993
+ tum optimization of maximum independent set using rydberg
1994
+ atom arrays,” Science, vol. 376, no. 6598, pp. 1209–1215, jun
1995
+ 2022.
1996
+ [19] M. Kim, K. Kim, J. Hwang, E.-G. Moon, and J. Ahn,
1997
+ “Rydberg quantum wires for maximum independent set
1998
+ problems with nonplanar and high-degree graphs,” 2021.
1999
+ [Online]. Available: https://arxiv.org/abs/2109.03517
2000
+ [20] B. Albrecht, C. Dalyac, L. Leclerc, L. Ortiz-Guti´errez,
2001
+ S. Thabet, M. D’Arcangelo, V. E. Elfving, L. Lassabli`ere,
2002
+ H. Silv´erio, B. Ximenez, L.-P. Henry, A. Signoles, and
2003
+ L. Henriet, “Quantum feature maps for graph machine learn-
2004
+ ing on a neutral atom quantum processor,” 2022.
2005
+ [21] L. Novo, S. Chakraborty, M. Mohseni, and Y. Omar,
2006
+ “Environment-assisted analog quantum search,” Physical
2007
+ Review A, vol. 98, no. 2, aug 2018.
2008
+ [22] C. Dalyac, L. Henriet, E. Jeandel, W. Lechner, S. Perdrix,
2009
+ M. Porcheron, and M. Veshchezerova, “Qualifying quantum
2010
+ approaches for hard industrial optimization problems. a case
2011
+ study in the field of smart-charging of electric vehicles,” EPJ
2012
+ Quantum Technology, vol. 8, no. 1, p. 12, 2021.
2013
+ [23] A. Rajak, S. Suzuki, A. Dutta, and B. K. Chakrabarti,
2014
+ “Quantum
2015
+ annealing:
2016
+ An
2017
+ overview,”
2018
+ 2022.
2019
+ [Online].
2020
+ Available: https://arxiv.org/abs/2207.01827
2021
+ [24] A. Cornejo and F. Kuhn, “Deploying wireless networks with
2022
+ beeps,” in International Symposium on Distributed Comput-
2023
+ ing.
2024
+ Springer, 2010, pp. 148–162.
2025
+ [25] D. Marx, “Graph colouring problems and their applications
2026
+ in scheduling,” Periodica Polytechnica Electrical Engineering
2027
+ (Archives), vol. 48, no. 1-2, pp. 11–16, 2004.
2028
+ [26] R. M. Karp, “Reducibility among combinatorial problems,”
2029
+ in Complexity of computer computations.
2030
+ Springer, 1972,
2031
+ pp. 85–103.
2032
+ [27] K. Kudo, “Constrained quantum annealing of graph color-
2033
+ ing,” Physical Review A, vol. 98, no. 2, p. 022301, 2018.
2034
+ [28] S. M. Ardelean and M. Udrescu, “Graph coloring using the
2035
+ reduced quantum genetic algorithm,” PeerJ Computer Sci-
2036
+ ence, vol. 8, p. e836, 2022.
2037
+ [29] O. Titiloye and A. Crispin, “Quantum annealing of the graph
2038
+ coloring problem,” Discrete Optimization, vol. 8, no. 2, pp.
2039
+ 376–384, 2011.
2040
+ [30] C. Silva, A. Aguiar, P. Lima, and I. Dutra, “Mapping graph
2041
+ coloring to quantum annealing,” Quantum Machine Intelli-
2042
+ gence, vol. 2, no. 2, pp. 1–19, 2020.
2043
+ [31] Z. Tabi, K. H. El-Safty, Z. Kallus, P. H´aga, T. Kozsik,
2044
+ A. Glos, and Z. Zimbor´as, “Quantum optimization for the
2045
+ graph coloring problem with space-efficient embedding,” in
2046
+ 2020 IEEE International Conference on Quantum Comput-
2047
+ ing and Engineering (QCE).
2048
+ IEEE, 2020, pp. 56–62.
2049
+ [32] J. Kwok and K. Pudenz, “Graph coloring with quantum
2050
+ annealing,” 2020. [Online]. Available:
2051
+ https://arxiv.org/
2052
+ abs/2012.04470
2053
+ [33] A. Fabrikant and T. Hogg, “Graph coloring with quantum
2054
+ heuristics,” in AAAI/IAAI, 2002, pp. 22–27.
2055
+ [34] K. Shimizu and R. Mori, “Exponential-time quantum algo-
2056
+ rithms for graph coloring problems,” Algorithmica, pp. 1–19,
2057
+ 2022.
2058
+ [35] A. Ambainis, K. Balodis, J. Iraids, M. Kokainis, K. Pr¯usis,
2059
+ and J. Vihrovs, “Quantum speedups for exponential-time
2060
+ dynamic programming algorithms,” in Proceedings of the
2061
+ Thirtieth Annual ACM-SIAM Symposium on Discrete Algo-
2062
+ rithms.
2063
+ SIAM, 2019, pp. 1783–1793.
2064
+ [36] G. Vitali, P. Viviani, C. Vercellino, A. Scarabosio, A. Scionti,
2065
+ O. Terzo, E. Giusto, and B. Montrucchio, “Towards optimal
2066
+ graph coloring using rydberg atoms,” in The International
2067
+ Conference for High Performance Computing, Networking,
2068
+
2069
+ 15
2070
+ Storage, and Analysis, Research posters,
2071
+ 2021.
2072
+ [Online].
2073
+ Available:
2074
+ https://sc21.supercomputing.org/presentation/
2075
+ ?id=rpost113&sess=sess278
2076
+ [37] J. Ossorio-Castillo and F. Pena-Brage, “Optimization of a
2077
+ refinery scheduling process with column generation and a
2078
+ quantum annealer,” Optimization and Engineering, vol. 23,
2079
+ no. 3, pp. 1471–1488, 2022.
2080
+ [38] H. Pichler, S.-T. Wang, L. Zhou, S. Choi, and M. D.
2081
+ Lukin, “Quantum optimization for maximum independent
2082
+ set using rydberg atom arrays,” 2018. [Online]. Available:
2083
+ https://arxiv.org/abs/1808.10816
2084
+ [39] S. Martiel, T. Ayral, and C. Allouche, “Benchmarking
2085
+ quantum coprocessors in an application-centric, hardware-
2086
+ agnostic, and scalable way,” IEEE Transactions on Quantum
2087
+ Engineering, vol. 2, pp. 1–11, 2021.
2088
+ [40] M. Balinski and A. W. Tucker, “Duality theory of linear pro-
2089
+ grams: A constructive approach with applications,” Siam
2090
+ Review, vol. 11, no. 3, pp. 347–377, 1969.
2091
+ [41] H. Breu and D. G. Kirkpatrick, “Unit disk graph recognition
2092
+ is np-hard,” Computational Geometry, vol. 9, no. 1-2, pp.
2093
+ 3–24, 1998.
2094
+ [42] “Using QAOA and QAA to solve a ud-mis problem,” https://
2095
+ pulser.readthedocs.io/en/latest/tutorials/qaoa mis.html, ac-
2096
+ cessed: 2022-11-05.
2097
+ [43] T. Albash and D. A. Lidar, “Adiabatic quantum computa-
2098
+ tion,” Reviews of Modern Physics, vol. 90, no. 1, p. 015002,
2099
+ 2018.
2100
+ [44] D.
2101
+ Bluvstein,
2102
+ A.
2103
+ Omran,
2104
+ H.
2105
+ Levine,
2106
+ A.
2107
+ Keesling,
2108
+ G. Semeghini, S. Ebadi, T. T. Wang, A. A. Michailidis,
2109
+ N. Maskara, W. W. Ho, S. Choi, M. Serbyn, M. Greiner,
2110
+ V. Vuleti´c, and M. D. Lukin, “Controlling quantum many-
2111
+ body dynamics in driven rydberg atom arrays,” Science,
2112
+ vol. 371, no. 6536, pp. 1355–1359, 2021. [Online]. Available:
2113
+ https://www.science.org/doi/abs/10.1126/science.abg2530
2114
+ [45] V. Batagelj and U. Brandes, “Efficient generation of large
2115
+ random networks,” Physical Review E, vol. 71, no. 3, p.
2116
+ 036113, 2005.
2117
+ [46] M. Penrose, Random geometric graphs.
2118
+ OUP Oxford, 2003,
2119
+ vol. 5.
2120
+ [47] E. Malaguti and P. Toth, “A survey on vertex coloring prob-
2121
+ lems,” International transactions in operational research,
2122
+ vol. 17, no. 1, pp. 1–34, 2010.
2123
+ [48] “Glpk - gnu linear programming kit,” https://www.gnu.org/
2124
+ software/glpk/, accessed: 2022-11-05.
2125
+ [49] “D-Wave
2126
+ simulated
2127
+ annealing
2128
+ qubo
2129
+ sampler,”
2130
+ https://docs.ocean.dwavesys.com/projects/neal/en/latest/
2131
+ reference/sampler.html, accessed: 2022-12-21.
2132
+ [50] A. Hagberg, P. Swart, and D. S Chult, “Exploring net-
2133
+ work structure, dynamics, and function using networkx,”
2134
+ Los Alamos National Lab.(LANL), Los Alamos, NM (United
2135
+ States), Tech. Rep., 2008.
2136
+ [51] H. Silv´erio, S. Grijalva, C. Dalyac, L. Leclerc, P. J. Karalekas,
2137
+ N. Shammah, M. Beji, L.-P. Henry, and L. Henriet, “Pulser:
2138
+ An open-source package for the design of pulse sequences
2139
+ in programmable neutral-atom arrays,” Quantum, vol. 6, p.
2140
+ 629, 2022.
2141
+ [52] M. Veshchezerova, “Quantum algorithms for energy manage-
2142
+ ment optimization problems,” Ph.D. dissertation, Ecole Doc-
2143
+ torale IAEM, 2022.
2144
+ [53] T. M. Fruchterman and E. M. Reingold, “Graph drawing
2145
+ by force-directed placement,” Software: Practice and experi-
2146
+ ence, vol. 21, no. 11, pp. 1129–1164, 1991.
2147
+
9tE0T4oBgHgl3EQfwwGF/content/tmp_files/load_file.txt ADDED
The diff for this file is too large to render. See raw diff
 
9tE1T4oBgHgl3EQf8AWv/content/tmp_files/2301.03541v1.pdf.txt ADDED
@@ -0,0 +1,646 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ A unipolar quantum dot diode structure for advanced quantum light sources
2
+ T. Strobel,1, ∗ J. H. Weber,1, ∗ M. Schmidt,2 L. Wagner,1 L. Engel,1 M.
3
+ Jetter,1 A. D. Wieck,2 S. L. Portalupi,1 A. Ludwig,2 and P. Michler1
4
+ 1Institut für Halbleiteroptik und Funktionelle Grenzflächen,
5
+ Center for Integrated Quantum Science and Technology (IQST) and SCoPE,
6
+ University of Stuttgart, Allmandring 3, 70569 Stuttgart, Germany
7
+ 2Lehrstuhl für Angewandte Festkörperphysik,
8
+ Ruhr-Universität Bochum, D-44780 Bochum, Germany
9
+ (Dated: January 10, 2023)
10
+ 1
11
+ arXiv:2301.03541v1 [quant-ph] 9 Jan 2023
12
+
13
+ Abstract
14
+ Triggered, indistinguishable, single photons play a central role in various quantum photonic implemen-
15
+ tations. Here, we realize a novel n+−i−n++ diode structure embedding semiconductor quantum dots: the
16
+ gated device enables spectral tuning of the transitions and deterministic control of the observed charged
17
+ states. Blinking-free single-photon emission and high two-photon indistinguishability is observed. The
18
+ linewidth’s temporal evolution is investigated for timescales spanning more than 6 orders of magnitude,
19
+ combining photon-correlation Fourier spectroscopy, high-resolution photoluminescence spectroscopy, and
20
+ two-photon interference (visibility of VTPI,2ns = (85.5±2.2) % and VTPI,9ns = (78.3±3.0) %). No spectral
21
+ diffusion or decoherence on timescales above ∼ 9ns is observed for most of the dots, and the emitted pho-
22
+ tons’ linewidth ((420±30) MHz) deviates from the Fourier-transform limit only by a factor of 1.68. Thus,
23
+ for remote TPI experiments, visibilities above 74% are anticipated. The presence of n-doping only signifies
24
+ higher available carrier mobility, making the presented device highly attractive for future development of
25
+ high-speed tunable, high-performance quantum light sources.
26
+ Quantum optical implementations and applications require sources of non-classical light ca-
27
+ pable of emitting single photons on-demand and with a high degree of indistinguishability [1].
28
+ Furthermore, for upscaling the experimental complexity, remote sources capable of emitting light
29
+ at the same wavelength are highly desirable [2–6]. Semiconductor quantum dots have shown
30
+ potentials to fulfill all the aforementioned needs, additionally being able to control the emission
31
+ wavelength via various mechanisms, i.e. the application of electric [2] or magnetic field [7], as well
32
+ as the use of external mechanical strain [8, 9]. Being embedded in a semiconductor matrix allows
33
+ for the realization of high-quality photonic resonators [10–12], as well as the implementation of
34
+ compact diode structures to control the emission wavelength via local tuning [13]. Interestingly,
35
+ placing the quantum dots (QDs) into an electrically gated structure further provides a stabiliza-
36
+ tion of the carrier environment which decreases the impact of spectral diffusion on the photon
37
+ linewidth [14, 15]. These possibilities culminated in the realization of a source of single- and
38
+ indistinguishable-photons with an end-to-end efficiency as high as 57% [16], having the sample
39
+ been grown via molecular beam epitaxy (MBE) embedding the emitters into a p-i-n diode struc-
40
+ ture. Despite these recent results, further improvements in the sample design and realization can
41
+ be obtained: from the growth point of view, the presence of a p-layer in the implementation of
42
+ the diode embedding the QDs requires the doping with carbon atoms which constitute an impurity
43
+ 2
44
+
45
+ during growth as well as in the MBE chamber itself, even though there is a minimal memory ef-
46
+ fect [15, 17, 18]. In high-frequency electrical device applications, using holes in p-doped structures
47
+ instead of electrons in n-doped structures would limit the achievable speed due to their 20-times
48
+ lower mobility allowing for fast control [19]. For example, a scheme theoretically proposed in
49
+ Ref. [20] indeed requires electrical Stark shift of the QD transitions on sub-picosecond timescales
50
+ to implement cavity-mediated single and photon-pair generation with QDs.
51
+ For these reasons, in the present study, the quantum dots have been embedded into a n+−i−n++
52
+ diode structure, while the light extraction is enhanced by a planar cavity design formed by two
53
+ distributed Bragg reflectors (DBR) above and below the emitters. This novel diode structure
54
+ was implemented performing a two-step growth combining metal organic vapor phase epitaxy
55
+ (MOVPE) for the n-doped, bottom DBR, and MBE for the QD and gate diode, as well as the top
56
+ DBR. On the one hand, MOVPE allows for a fast deposition of high-quality multilayers form-
57
+ ing high-reflectivity DBRs, being the growth performed at high temperature and low vacuum.
58
+ On the other hand, MBE with its high-vacuum and high purity growth conditions, enables the
59
+ slow and controlled deposition of semiconductor nanostructures with a defect-free environment,
60
+ resulting in high-coherence photon emission [6, 18, 21–23]. In the following, the optical and
61
+ quantum optical properties of the emitted photons from the n+−i−n++ diode structure will be
62
+ reported. In particular, high single-photon purity and indistinguishability have been observed re-
63
+ spectively via Hanbury-Brown and Twiss, and Hong-Ou-Mandel-type experiments. Fabry-Perot
64
+ interferometry allowed for measuring the static spectra of the emitted photons in high resolution
65
+ and for comparing the linewidth with the expected Fourier-transform (FT) limit (obtained from
66
+ decay time measurements). Photon-correlation Fourier spectroscopy (PCFS) [24, 25] proves that
67
+ spectral broadening mechanisms are absent in the large majority of the investigated QDs, while
68
+ small deviations from the FT limit act on timescales shorter than a few nanoseconds, in accordance
69
+ with two-photon interference measurements. In line with pioneering p-i-n-type diodes the novel
70
+ n+−i−n++ diode structure further enables the Stark tuning of the QD transitions, together with a
71
+ precise control of the observed charge states in the dot. Finally, voltage dependent studies prove
72
+ the stabilization effect of the diode structure, having a drastic reduction of the emission linewidth
73
+ for the designed operation conditions.
74
+ 3
75
+
76
+ Norm. RF Intensity
77
+ 0
78
+ 1
79
+ Frequency detuning (GHz)
80
+ −1
81
+ 0
82
+ 1
83
+ data
84
+ fit
85
+ SR
86
+ QD Layer
87
+ AlAs
88
+ GaAs
89
+ GaAs n+
90
+ GaAs n++
91
+ AlGaAs n+
92
+ Gold
93
+ AlGaAs
94
+ Norm. coincicences
95
+ 0
96
+ 1
97
+ Time delay (ns)
98
+ −10
99
+ 0
100
+ 10
101
+ 0
102
+ 1
103
+ −1000
104
+ 0
105
+ 1000
106
+ E-field
107
+ Vg
108
+ MOVPE MBE
109
+ DBR
110
+ DBR
111
+ n
112
+ n
113
+ i
114
+ a
115
+ f
116
+ e
117
+ Wavelength (nm)
118
+ 904.5
119
+ 903.0
120
+ 901.5
121
+ 900.0
122
+ Gate Voltage (mV)
123
+ −2000
124
+ −1000
125
+ 0
126
+ T = 6K
127
+ X0
128
+ X-
129
+ XX
130
+ b
131
+ Gate Voltage (mV)
132
+ −600
133
+ −300
134
+ 0
135
+ c
136
+ Norm. RF Intensity
137
+
138
+ 0
139
+ 14
140
+ 28
141
+ 42
142
+ 56
143
+ 70
144
+
145
+ data
146
+ fit
147
+ √Excitation power (√nW)
148
+ d
149
+ Norm. Intensity
150
+ 0
151
+ 1
152
+ FIG. 1. Sample description and characterization: a, Schematic of the sample structure. b, µ-PL of one
153
+ selected quantum dot as a function of gate voltage using an AB pumping scheme. c, RF signal of the same
154
+ QD, under resonant excitation of the trion transition. d, Resonant fluorescence intensity over the square root
155
+ of the (pulsed) laser power. e, Second-order autocorrelation measurement of the investigated trion line: in
156
+ the inset, long time delay data (with 13 ns binning) show the absence of blinking. The data are normalized
157
+ to the Poissonian level. f, High-resolution FPI measurement of the trion linewidth (under pulsed resonant
158
+ excitation for Vg = −540mV applied voltage). Data (solid blue), fit (solid red) and the system response
159
+ (SR) function (dashed) are shown.
160
+ DEVICE DESIGN AND RESONANT EXCITATION
161
+ The sample employed has been grown by combining MOVPE and MBE techniques.
162
+ A
163
+ schematic view of its structure is depicted in Fig. 1a. In a first step, n+-doped bottom DBRs
164
+ are grown with MOVPE. Then, the sample is removed from the reactor and shipped for the subse-
165
+ quent MBE covering of the InAs QDs embedded in the n+−i−n++ gate diode (see Methods).
166
+ We first investigate the micro-photoluminescence (µ-PL) spectrum (in above barrier (AB)
167
+ pumping scheme at saturation) as a function of the applied gate voltage Vg. The acquired data
168
+ 4
169
+
170
+ are depicted as a voltage/wavelength intensity map in Fig. 1b. Starting from a negative bias,
171
+ several distinct lines appear and disappear as Vg is increased towards 0 V. Two-photon excitation
172
+ (TPE) and decay time measurements (see Supplementary Fig. S1 and S3), allow for identifying
173
+ the transitions as neutral exciton and biexciton, and negatively charged trion respectively (as this
174
+ transition appears at a bias where a negative charged QD is energetically more favorable). At low
175
+ pumping rates (see Supplementary Fig. S2), only trion or exciton lines are present for specific
176
+ applied voltage values [26]: this controlled switching can be understood as a consequence of the
177
+ Coulomb blockade. By applying gate voltages, the position of the discrete energy levels in the QD
178
+ relative to the Fermi sea changes. Depending on the voltage level certain excitonic states can be
179
+ favored.
180
+ The emission lines undergo a wavelength shift (71.1±0.2 GHz V−1, ∼2.8·10−3 GHz per V cm−1)
181
+ with changing Vg. This change in wavelength is the characteristic dc Stark shift [27] caused by
182
+ the electrostatic field of the diode structure. These findings demonstrate the controlled switching
183
+ of electronic states in this novel structure as well as the wavelength tunability with applied voltage.
184
+ Fig. 1c shows the evolution of the trion wavelength under resonant pumping for various ap-
185
+ plied voltages, where again a Stark shift of the emission wavelength can be observed (72.7 ±
186
+ 0.6 GHz V−1, ∼2.9 · 10−3 GHz per V cm−1). Under pulsed excitation, the trion resonance fluo-
187
+ rescence intensity shows clear Rabi oscillations (see Fig. 1d), proving coherent control of the state
188
+ population: the observed oscillations yield a state preparation fidelity of ≈ 85%.
189
+ Under resonant excitation at the π-pulse, the second-order correlation plotted in Fig. 1e re-
190
+ veals a pronounced anti-bunching at zero time delay, with a single-photon purity of g(2) (0) =
191
+ 0.028 ± 0.001. Furthermore no blinking is observed under resonant pumping in the whole time
192
+ delays considered in the histogram of correlations (as shown in the inset of Fig. 1e with time sep-
193
+ arations beyond ±1µs): this represents an important characteristic for the implementation of high
194
+ brightness sources of quantum light. Besides that, the absence of p-doping helps in decreasing
195
+ the presence of impurities in the QD host material, impurities which may also result in blinking
196
+ dynamics at long time separation [28]. This blinking-free behavior is consistent with studies on
197
+ similar diode-like heterostructures utilizing the Coulomb blockade to stabilize the charge envi-
198
+ ronment [29]. For different applied voltages, it is also shown that resonant two-photon excitation
199
+ (TPE) can be employed to generate exciton-biexciton pairs (see Supplementary Fig. S1).
200
+ 5
201
+
202
+ Relative detuning (GHz)
203
+ Norm. Intensiy
204
+ 0
205
+ 2
206
+ 4
207
+ −4
208
+ 0
209
+ 4
210
+ 2
211
+ -2
212
+ a
213
+ -470mV
214
+ -660mV
215
+ -630mV
216
+ -540mV
217
+ -450mV
218
+ -440mV
219
+ -420mV
220
+ c
221
+ b
222
+ HOM I
223
+ HOM II
224
+ -420mV
225
+ -450mV
226
+ -540mV
227
+ -660mV
228
+ -440mV
229
+ -470mV
230
+ -630mV
231
+ FT limit
232
+ Linewidth (GHz)
233
+ 0
234
+ 1
235
+ 2
236
+ 3
237
+ 4
238
+ Int. emission rate (arb. u.)
239
+ 0
240
+ 5
241
+ 10
242
+ Gate voltage (mV)
243
+ −750
244
+ −600
245
+ −450
246
+ −300
247
+ PCFS linewidth (GHz)
248
+ 0
249
+ 1
250
+ 2
251
+ 3
252
+ 4
253
+ Time delay (s)
254
+ 1e−08
255
+ 1e−06
256
+ 1e−04
257
+ 1e−02
258
+ FIG. 2. Linewidth investigation of the trion line at the π-pulse for different gate voltage levels: a,
259
+ High resolution FPI spectra for different gate voltages (vertically shifted for clarity). b, Emission linewidth
260
+ extracted from the FPI data in a (blue dots). For comparison the RF emission intensity extracted from the
261
+ voltage map in Fig. 1c is shown in black. The two crosses indicate the conditions for the successive two-
262
+ photon interference measurements of Fig. 3 and Tab. I. c, PCFS measurements from ns to ms timescales.
263
+ The estimated lifetime-limited linewidth is shown in black (FL). For each voltage the linewidth is a straight
264
+ line indicating no spectral dynamics on the mentioned timescales. Moving away from the center position of
265
+ the charge plateau in the voltage scan an increase of the emission linewidth is observed.
266
+ A charge-stable QD environment, in combination with a low density of impurities and defects,
267
+ is also supposed to positively impact the emission linewidth. For this reason, we investigate the
268
+ emission linewidth under resonant pumping at the π-pulse. First, a scanning Fabry-Perot inter-
269
+ ferometer (FPI) is employed for recording high-resolution stationary spectra of the investigated
270
+ QDs (see Methods). Fig. 1f shows the measured emitted photons’ linewidth for the trion transition
271
+ under investigation reaching a value of (420±30) MHz, broadened only by a factor of 1.68 com-
272
+ pared to the FT limit (∆νFL = (250±20) MHz). This measured close-to lifetime-limited linewidth
273
+ demonstrates a modest impact of dephasing and spectral diffusion in the presented heterostructure.
274
+ LINEWIDTH TEMPORAL EVOLUTION OVER APPLIED GATE VOLTAGE
275
+ Following this first characterization, we conduct FPI measurements for various applied gate
276
+ voltages, and the results are summarized in Fig. 2a. As it can be seen, the observed linewidth
277
+ 6
278
+
279
+ varies drastically with the applied bias. The emission linewidth extracted from fitting the FPI
280
+ measurements is reported in Fig. 2b (blue dots): interestingly, a voltage range exists for which
281
+ the linewidth reaches minimal values which corresponds to a maximum in the observed µ-PL in-
282
+ tensity (black solid line). Outside this plateau, the measured linewidth increases, accompanied
283
+ by a decrease in luminescence. In line with previous studies, the observed line broadening can
284
+ be attributed to cotunneling [30–33]: the QD is tunnel-coupled to the Fermi sea, with increased
285
+ tunneling interaction for voltage levels outside the shown stable region, hence decreasing the pho-
286
+ ton coherence. At the center of the plateau tunnel coupling is inhibited increasing the photon
287
+ coherence time, hence minimizing the linewidth.
288
+ Despite the narrow linewidth observed at the center of the voltage plateau, it is useful to investi-
289
+ gate the origin of potential dephasing and spectral diffusion mechanisms responsible for the small
290
+ deviation from the Fourier limit. To do so, PCFS is employed [24, 25]. PCFS enables measuring
291
+ the time evolution of the linewidth of the emitted photons, with high temporal and spectral resolu-
292
+ tion and for timescales that can vary from few nanoseconds to few milliseconds (see Methods).
293
+ Exemplary results of PCFS measurements are reported in Fig. 2c, where the applied gate voltage
294
+ has also been varied in order to provide a profound insight on the impact of the applied electric
295
+ field on the emission linewidth. As it can be seen, the PCFS results show that, for all applied
296
+ voltages, the linewidth remains constant over time, where only the absolute value is changing.
297
+ The lowest measured linewidth in PCFS is 520 ± 100MHz (Vg = −570mV) which is very close
298
+ to the FT limit (dashed line) as it also was observed in the previous FPI measurement recorded for
299
+ similar applied voltages (see Fig. 1f). The PCFS measured linewidth is close to the resolution limit
300
+ of the PCFS setup, which could explain the slightly higher value with respect to the analogous FPI
301
+ value, which corresponds to the stationary limit of the emission spectrum [34]. This agreement
302
+ between PCFS at long timescales and FPI measurements indicate that any deviation from the FT
303
+ limit is due to dephasing and spectral diffusion mechanisms happening at timescales shorter than
304
+ 10 ns. The same conclusion applies for the other applied voltages, since the long timescale PCFS
305
+ values match the corresponding FPI measurements (see Fig. 2b and Supplementary Fig. S4). This
306
+ supports the conclusion that the process responsible for this additional line broadening happens
307
+ at a timescale shorter than 10ns, since there is no further broadening, even for times longer than
308
+ 10ms.
309
+ The discussed results, further supported by previous studies [14, 30, 33], clearly indicate the
310
+ existence of a voltage range for which the linewidth is minimized. There, the small deviation from
311
+ 7
312
+
313
+ FT limit is proven to be due to mechanisms with dynamics faster than 10ns.
314
+ SHORT TIMESCALE DYNAMICS VIA VOLTAGE-DEPENDENT TWO-PHOTON INTERFER-
315
+ ENCE
316
+ To probe even shorter timescales, two-photon inference (TPI) measurements with consecutively
317
+ emitted photons are conducted (time separation between 2ns and 9ns), therefore extending the
318
+ investigated time range close to the radiative lifetime of the emitter. The measurements in Fig. 3a
319
+ show the central peaks around zero time delay with a clear signature of two-photon interference,
320
+ for an applied gate voltage within the previously observed plateau (here Vg = −570mV). In this
321
+ configuration, a TPI visibility as high as V −570mV
322
+ TPI
323
+ = (85.8±2.2) % is recorded for a photon time
324
+ separation of 2ns. This implies that the mechanism responsible for the small deviation from near-
325
+ unity visibility happens at timescales shorter than 2ns. Considering the rather small size of the
326
+ QDs, the effective coupling to acoustic phonons [35] could result in a dephasing mechanism which
327
+ acts at below nanosecond timescales: this would explain the deviation from FT limit and the re-
328
+ spective impact on the TPI.
329
+ To further investigate the broadening mechanisms, TPI measurements with time separations of 4ns
330
+ and 9ns were performed. An overview of the results is given in Tab. I. For the center of the charge
331
+ plateau at Vg = −570mV a decrease from VTPI,2ns = (85.5±2.2) % to VTPI,4ns = (79.7±2.5) %
332
+ (for 4ns time separation) and to VTPI,9ns = 78.3±3.0% (for 9ns) in the TPI visibility is observed.
333
+ This rather modest decrease of the TPI visibility can be attributed to spectral broadening mech-
334
+ anisms happening at such timescales (still not resolvable in PCFS measurements). Intriguingly,
335
+ estimating the reachable TPI visibility from the recorded stationary linewidth in FPI measurements
336
+ (Fig. 2a), a value of V sim
337
+ TPI = (74.3±1.5) % is expected [36]. This quantity would also represent the
338
+ achievable TPI visibility for photons stemming from remote sources. This value matches, within
339
+ margin of uncertainty, the observed value of VTPI,9ns = (78.3±3.0) %. This indicates that, to-
340
+ gether with broadening mechanisms happening on timescales smaller than 2ns, a small linewidth
341
+ broadening is further observed between 2ns and 9ns. Above this timescale value, no further broad-
342
+ ening mechanisms are observed: this is confirmed independently by PCFS measurements, and by
343
+ the agreement between the observed TPI at 9ns and the expected two-photon interference inferred
344
+ from the stationary spectrum (measured with FPI measurements).
345
+ Interestingly, for voltages outside the discussed stable region (here Vg = −450mV), the
346
+ 8
347
+
348
+ Vg(mV) VTPI,2 ns(%) VTPI,4 ns(%) VTPI,9 ns(%) Vsim
349
+ TPI(%)
350
+ −570
351
+ 85.5±2.2
352
+ 79.7±2.5
353
+ 78.3±3.0 74.3±1.5
354
+ −450
355
+ 14.9±3.6
356
+ 13.9±3.7
357
+ 14.6±3.5 14.5±1.0
358
+ TABLE I. TPI visibilities for different photon temporal delays and applied gate voltages. Moreover the
359
+ expected TPI visibility (Vsim
360
+ TPI) of statistically independent QD emissions is extracted from the static FPI
361
+ measurements.
362
+ observed TPI is drastically reduced.
363
+ As shown in Fig. 3b, a value as low as V −450mV
364
+ TPI
365
+ =
366
+ (14.9±3.6) % is observed. The applied voltage has been chosen in a range which has already a
367
+ clear impact on the emission linewidth, despite a modest reduction of the observed count rate (see
368
+ Fig. 2b). These findings are consistent with the observation on the line broadening: while for the
369
+ voltage range within the plateau the electric field stabilizes the environment, resulting in a close
370
+ to FT limited linewidth, outside this charge plateau the situation changes. There, carrier tunneling
371
+ induces a broadening of the linewidth, and the tunneling itself happens on time scales shorter than
372
+ 10ns (as seen in PCFS data) and than 2ns (as seen in TPI measurements). More than 95 % of the
373
+ investigated quantum dots (20 QDs) showed a linewidth behavior comparable with the reported
374
+ results (As depicted in Supplementary Fig. S5, only one dot showed linewidth temporal dynam-
375
+ ics in PCFS data, compatible with the presence of a local carrier trap next to the dot). Outside
376
+ this stable plateau, the TPI visibility remains low (≈ 14%) for all photon time separations and it
377
+ matches the value inferred from the linewidth: once again, this confirms the impact of dephasing
378
+ on timescales shorter than 2ns (see results in Table I).
379
+ CONCLUSIONS
380
+ In this study, MOVPE and MBE have been combined to realize high optical quality quantum
381
+ dots, embedded into a novel n+−i−n++ diode, and within a planar cavity formed by two DBRs.
382
+ The high quality DBR is ensured by the high temperature (and high speed) deposition of MOVPE,
383
+ while the MBE ensures the growth of QDs within low defect material structure. This, in com-
384
+ bination with the embedding diode enables the observation of close-to-FT limit QD linewidth
385
+ ((420±30) MHz), where high coherent control of the population is observed as well as high
386
+ single-photon purity (g(2) (0) = 0.028±0.001). The sample is investigated combining PCFS, FPI
387
+ 9
388
+
389
+ 0
390
+ 1
391
+ Delay time (ns)
392
+ −4
393
+ 0
394
+ 4
395
+ Norm. coincidences
396
+ 0
397
+ 1
398
+ b
399
+ a
400
+ HOM I: Vg = -570 mV
401
+ HOM II: Vg = -450 mV
402
+ fit
403
+ data
404
+ fit
405
+ FIG. 3. Two-photon interference: TPI measurement from the trion at the π-pulse for two different gate
406
+ voltages. Double pulses with 2 ns temporal separation were used to create the interfering photons. Un-
407
+ wanted laser background (or broad tails from phonon assisted emission) is filtered via a transmission spec-
408
+ trometer of spectral width ∆filter = 15GHz, much larger than the emission linewidth. The blue areas show
409
+ the measured data for parallel polarization, with their fit function in red. The brown areas correspond to
410
+ the fitted data of the orthogonal polarization measurement. a, TPI results for a voltage of Vg = −570mV
411
+ corresponding to the center of the charge plateau. b, measurement results for a voltage of Vg = −450mV at
412
+ the edge of the charge plateau (compare with Fig. 2b).
413
+ and TPI measurements enabling a study on emission linewidth and dynamics of the decoherence
414
+ mechanisms for timescales spanning more than 6 orders of magnitude. In particular, the small de-
415
+ viation from lifetime-limited spectra is investigated via PCFS and FPI measurements: combining
416
+ these two techniques it is possible to conclude that no spectral broadening mechanisms happen for
417
+ timescales between 10ns and the stationary limit (set by the FPI results). Furthermore, it has been
418
+ 10
419
+
420
+ clearly proven that the applied gate voltage allows for wavelength tuning and stabilizing the QD
421
+ charge environment, within a defined voltage range where the luminescence is maximized. Out-
422
+ side from this ideal plateau, the emission linewidth increases and the brightness decreases. Still,
423
+ thanks to PCFS we can conclude that the mechanisms responsible for this degradation outside the
424
+ ideal voltage range have a timescale below 10ns. Finally, two-photon interference measurements
425
+ are employed to investigate the timescales between 2ns and 9ns to provide further insights in a
426
+ time range not accessible by PCFS. These measurements show that, even for the smallest time
427
+ separation, the linewidth is still slightly impacted by fast dephasing mechanisms (below 2ns),
428
+ which we attribute to acoustic phonon coupling. Still, a small degradation of the TPI visibility is
429
+ observed increasing the photon time separation to 9ns: in this condition, the measured visibility is
430
+ consistent with the one expected by simulations, taking into account the stationary linewidth mea-
431
+ sured via FPI. This further demonstrates that the only decoherence mechanisms, despite modest,
432
+ are happening at relatively short timescales.
433
+ Phonon coupling can be reduced in the future by growing larger QDs (which couple less
434
+ to phonons) or by integrating the emitters in photonic microcavities: Purcell enhancement is
435
+ known to be beneficial for decreasing the impact of dephasing mechanisms, in particular at short
436
+ timescales, further improving the photon indistinguishability. Both approaches, i.e. growth of
437
+ larger QDs and use of photonic cavities, are fully compatible with the realized sample design. In-
438
+ terestingly, the absence of p-doping will enable in the near future the realization of devices where a
439
+ fast AC bias can be applied, thanks to the high electron mobility. Finally, the observed Stark shift
440
+ induced by the diode structure will have important application in realizing wavelength tunable
441
+ sources, fundamental requirement for the implementation of TPI from distinct devices: already
442
+ at the present stage, a remote visibility of ≈ 74% would be expected, a value much higher than
443
+ other reported for InGaAs QDs, only exceeded recently by GaAs quantum dots [6]. This makes
444
+ the implementation of an n+−i−n++ diode, embedding (larger) QDs into optical microcavities
445
+ highly desired for future quantum photonics.
446
+ Acknowledgments
447
+ The authors gratefully acknowledge the funding by the German Federal Ministry of Education
448
+ and Research (BMBF) via the project QR.X (No. 16KISQ013) and the company Quantum Design
449
+ for their persistent support. We would like to thank Sergej Vollmer for the support in MOVPE
450
+ 11
451
+
452
+ growth.
453
+ Author contributions
454
+ T.S., J.H.W. and L.W. performed the measurements and analyzed the data. M.S. and A.L. grew
455
+ the sample with the support of A.D.W.. L.E. fabricated the device. A.L. and M.J. designed the
456
+ sample. T.S. and S.L.P. wrote the manuscript with the support of J.H.W and P.M.. A.L., M.J.,
457
+ S.L.P., A.D.W. and P.M. coordinated the project. All authors contributed to scientific discussions
458
+ and revision of the manuscript.
459
+ ∗ These authors contributed equally
460
+ [1] P. Michler (Ed.), Quantum Dots for Quantum Information Technologies (Springer, 2017).
461
+ [2] R. B. Patel, A. J. Bennett, I. Farrer, C. A. Nicoll, D. A. Ritchie, and A. J. Shields, Two-photon inter-
462
+ ference of the emission from electrically tunable remote quantum dots, Nat. Photonics 4, 632 (2010).
463
+ [3] V. Giesz, S. L. Portalupi, T. Grange, C. Antón, L. De Santis, J. Demory, N. Somaschi, I. Sagnes,
464
+ A. Lemaître, L. Lanco, A. Auffèves, and P. Senellart, Cavity-enhanced two-photon interference using
465
+ remote quantum dot sources, Phys. Rev. B 92, 161302 (2015).
466
+ [4] J. H. Weber, J. Kettler, H. Vural, M. Müller, J. Maisch, M. Jetter, S. L. Portalupi, and P. Michler,
467
+ Overcoming correlation fluctuations in two-photon interference experiments with differently bright
468
+ and independently blinking remote quantum emitters, Phys. Rev. B 97, 195414 (2018).
469
+ [5] J. H. Weber, B. Kambs, J. Kettler, S. Kern, J. Maisch, H. Vural, M. Jetter, S. L. Portalupi, C. Becher,
470
+ and P. Michler, Two-photon interference in the telecom C-band after frequency conversion of photons
471
+ from remote quantum emitters, Nat. Nanotechnol. 14, 23 (2019).
472
+ [6] L. Zhai, G. N. Nguyen, C. Spinnler, J. Ritzmann, M. C. Löbl, A. D. Wieck, A. Ludwig, A. Javadi, and
473
+ R. J. Warburton, Quantum interference of identical photons from remote GaAs quantum dots, Nat.
474
+ Nanotechnol. 17, 829 (2022).
475
+ [7] N. Akopian, U. Perinetti, L. Wang, A. Rastelli, O. G. Schmidt, and V. Zwiller, Tuning single GaAs
476
+ quantum dots in resonance with a rubidium vapor, Appl. Phys. Lett. 97, 082103 (2010).
477
+ [8] R. Trotta, E. Zallo, C. Ortix, P. Atkinson, J. D. Plumhof, J. van den Brink, A. Rastelli, and O. G.
478
+ Schmidt, Universal Recovery of the Energy-Level Degeneracy of Bright Excitons in InGaAs Quantum
479
+ 12
480
+
481
+ Dots without a Structure Symmetry, Phys. Rev. Lett. 109, 147401 (2012).
482
+ [9] J. Martín-Sánchez, R. Trotta, A. Mariscal, R. Serna, G. Piredda, S. Stroj, J. Edlinger, C. Schimpf,
483
+ J. Aberl, T. Lettner, J. Wildmann, H. Huang, X. Yuan, D. Ziss, J. Stangl, and A. Rastelli, Strain-tuning
484
+ of the optical properties of semiconductor nanomaterials by integration onto piezoelectric actuators,
485
+ Semicond. Sci. Technol. 33, 013001 (2018).
486
+ [10] H. Wang, Z.-C. Duan, Y.-H. Li, S. Chen, J.-P. Li, Y.-M. He, M.-C. Chen, Y. He, X. Ding, C.-Z. Peng,
487
+ C. Schneider, M. Kamp, S. Höfling, C.-Y. Lu, and J.-W. Pan, Near-Transform-Limited Single Photons
488
+ from an Efficient Solid-State Quantum Emitter, Phys. Rev. Lett. 116, 213601 (2016).
489
+ [11] H. Wang, H. Hu, T.-H. Chung, J. Qin, X. Yang, J.-P. Li, R.-Z. Liu, H.-S. Zhong, Y.-M. He, X. Ding, Y.-
490
+ H. Deng, Q. Dai, Y.-H. Huo, S. Höfling, C.-Y. Lu, and J.-W. Pan, On-Demand Semiconductor Source
491
+ of Entangled Photons Which Simultaneously Has High Fidelity, Efficiency, and Indistinguishability,
492
+ Phys. Rev. Lett. 122, 113602 (2019).
493
+ [12] J. Liu, R. Su, Y. Wei, B. Yao, S. F. C. da Silva, Y. Yu, J. Iles-Smith, K. Srinivasan, A. Rastelli,
494
+ J. Li, and X. Wang, A solid-state source of strongly entangled photon pairs with high brightness and
495
+ indistinguishability, Nat. Nanotechnol. 14, 586 (2019).
496
+ [13] N. Somaschi, V. Giesz, L. De Santis, J. C. Loredo, M. P. Almeida, G. Hornecker, S. L. Portalupi,
497
+ T. Grange, C. Antón, J. Demory, C. Gómez, I. Sagnes, N. D. Lanzillotti-Kimura, A. Lemaítre, A. Auf-
498
+ feves, A. G. White, L. Lanco, and P. Senellart, Near-optimal single-photon sources in the solid state,
499
+ Nat. Photonics 10, 340 (2016).
500
+ [14] A. V. Kuhlmann, J. H. Prechtel, J. Houel, A. Ludwig, D. Reuter, A. D. Wieck, and R. J. Warburton,
501
+ Transform-limited single photons from a single quantum dot, Nat. Commun. 6, 8204 (2015).
502
+ [15] J. H. Prechtel, A. V. Kuhlmann, J. Houel, A. Ludwig, S. R. Valentin, A. D. Wieck, and R. J. Warburton,
503
+ Decoupling a hole spin qubit from the nuclear spins, Nat. Mater. 15, 981 (2016).
504
+ [16] N. Tomm, A. Javadi, N. O. Antoniadis, D. Najer, M. C. Löbl, A. R. Korsch, R. Schott, S. R. Valentin,
505
+ A. D. Wieck, A. Ludwig, and R. J. Warburton, A bright and fast source of coherent single photons,
506
+ Nat. Nanotechnol. 16, 399 (2021).
507
+ [17] D. Reuter, A. D. Wieck, and A. Fischer, A compact electron beam evaporator for carbon doping in
508
+ solid source molecular beam epitaxy, Rev. Sci. Instrum. 70, 3435 (1999).
509
+ [18] A. Ludwig, J. H. Prechtel, A. V. Kuhlmann, J. Houel, S. R. Valentin, R. J. Warburton, and A. D.
510
+ Wieck, Ultra-low charge and spin noise in self-assembled quantum dots, J. Cryst. Growth 477, 193
511
+ (2017).
512
+ 13
513
+
514
+ [19] F. T. Pedersen, Y. Wang, C. T. Olesen, S. Scholz, A. D. Wieck, A. Ludwig, M. C. Löbl, R. J. Warburton,
515
+ L. Midolo, R. Uppu, and P. Lodahl, Near Transform-Limited Quantum Dot Linewidths in a Broadband
516
+ Photonic Crystal Waveguide, ACS Photonics 7, 2343 (2020).
517
+ [20] D. Bauch, D. Heinze, J. Förstner, K. D. Jöns, and S. Schumacher, Ultrafast electric control of cavity
518
+ mediated single-photon and photon-pair generation with semiconductor quantum dots, Phys. Rev. B
519
+ 104, 085308 (2021).
520
+ [21] W. P. McCray, MBE deserves a place in the history books, Nat. Nanotechnol. 2, 259 (2007).
521
+ [22] D. Najer, I. Söllner, P. Sekatski, V. Dolique, M. C. Löbl, D. Riedel, R. Schott, S. Starosielec, S. R.
522
+ Valentin, A. D. Wieck, N. Sangouard, A. Ludwig, and R. J. Warburton, A gated quantum dot strongly
523
+ coupled to an optical microcavity, Nature 575, 622 (2019).
524
+ [23] A. N. Kosarev, A. V. Trifonov, I. A. Yugova, I. I. Yanibekov, S. V. Poltavtsev, A. N. Kamenskii, S. E.
525
+ Scholz, C. A. Sgroi, A. Ludwig, A. D. Wieck, D. R. Yakovlev, M. Bayer, and I. A. Akimov, Extending
526
+ the time of coherent optical response in ensemble of singly-charged InGaAs quantum dots, Commun.
527
+ Phys. 5, 144 (2022).
528
+ [24] X. Brokmann, M. Bawendi, L. Coolen, and J.-P. Hermier, Photon-correlation Fourier spectroscopy,
529
+ Opt. Express 14, 6333 (2006).
530
+ [25] C. Schimpf, M. Reindl, P. Klenovský, T. Fromherz, S. F. Covre Da Silva, J. Hofer, C. Schneider,
531
+ S. Höfling, R. Trotta, and A. Rastelli, Resolving the temporal evolution of line broadening in single
532
+ quantum emitters, Opt. Express 27, 35290 (2019).
533
+ [26] M. C. Löbl, I. Söllner, A. Javadi, T. Pregnolato, R. Schott, L. Midolo, A. V. Kuhlmann, S. Stobbe,
534
+ A. D. Wieck, P. Lodahl, A. Ludwig, and R. J. Warburton, Narrow optical linewidths and spin pumping
535
+ on charge-tunable close-to-surface self-assembled quantum dots in an ultrathin diode, Phys. Rev. B
536
+ 96, 165440 (2017).
537
+ [27] G. W. Wen, J. Y. Lin, H. X. Jiang, and Z. Chen, Quantum-confined Stark effects in semiconductor
538
+ quantum dots, Phys. Rev. B 52, 5913 (1995).
539
+ [28] J. Houel, J. H. Prechtel, A. V. Kuhlmann, D. Brunner, C. E. Kuklewicz, B. D. Gerardot, N. G. Stoltz,
540
+ P. M. Petroff, and R. J. Warburton, High Resolution Coherent Population Trapping on a Single Hole
541
+ Spin in a Semiconductor Quantum Dot, Phys. Rev. Lett. 112, 107401 (2014).
542
+ [29] L. Zhai, M. C. Löbl, G. N. Nguyen, J. Ritzmann, A. Javadi, C. Spinnler, A. D. Wieck, A. Ludwig,
543
+ and R. J. Warburton, Low-noise GaAs quantum dots for quantum photonics, Nat. Commun. 11, 4745
544
+ (2020).
545
+ 14
546
+
547
+ [30] J. M. Smith, P. A. Dalgarno, R. J. Warburton, A. O. Govorov, K. Karrai, B. D. Gerardot, and P. M.
548
+ Petroff, Voltage Control of the Spin Dynamics of an Exciton in a Semiconductor Quantum Dot, Phys.
549
+ Rev. Lett. 94, 197402 (2005).
550
+ [31] J. Dreiser, M. Atatüre, C. Galland, T. Müller, A. Badolato, and A. Imamoglu, Optical investigations
551
+ of quantum dot spin dynamics as a function of external electric and magnetic fields, Phys. Rev. B 77,
552
+ 075317 (2008).
553
+ [32] C. Latta, A. Högele, Y. Zhao, A. N. Vamivakas, P. Maletinsky, M. Kroner, J. Dreiser, I. Carusotto,
554
+ A. Badolato, D. Schuh, W. Wegscheider, M. Atature, and A. Imamoglu, Confluence of resonant laser
555
+ excitation and bidirectional quantum-dot nuclear-spin polarization, Nat. Phys. 5, 758 (2009).
556
+ [33] A. Reigue, A. Lemaître, C. Gomez Carbonell, C. Ulysse, K. Merghem, S. Guilet, R. Hostein, and
557
+ V. Voliotis, Resonance fluorescence revival in a voltage-controlled semiconductor quantum dot, Appl.
558
+ Phys. Lett. 112, 073103 (2018).
559
+ [34] H. Vural, J. Maisch, I. Gerhardt, M. Jetter, S. L. Portalupi, and P. Michler, Characterization of spectral
560
+ diffusion by slow-light photon-correlation spectroscopy, Phys. Rev. B 101, 161401 (2020).
561
+ [35] E. A. Zibik, T. Grange, B. A. Carpenter, N. E. Porter, R. Ferreira, G. Bastard, D. Stehr, S. Winnerl,
562
+ M. Helm, H. Y. Liu, M. S. Skolnick, and L. R. Wilson, Long lifetimes of quantum-dot intersublevel
563
+ transitions in the terahertz range, Nat. Mater. 8, 803 (2009).
564
+ [36] B. Kambs and C. Becher, Limitations on the indistinguishability of photons from remote solid state
565
+ sources, New J. Phys. 20, 115003 (2018).
566
+ [37] M. C. Löbl, S. Scholz, I. Söllner, J. Ritzmann, T. Denneulin, A. Kovács, B. E. Kardynał, A. D. Wieck,
567
+ A. Ludwig, and R. J. Warburton, Excitons in InGaAs quantum dots without electron wetting layer
568
+ states, Commun. Phys. 2, 93 (2019).
569
+ [38] A. V. Kuhlmann, J. Houel, D. Brunner, A. Ludwig, D. Reuter, A. D. Wieck, and R. J. Warburton, A
570
+ dark-field microscope for background-free detection of resonance fluorescence from single semicon-
571
+ ductor quantum dots operating in a set-and-forget mode, Rev. Sci. Instrum. 84, 073905 (2013).
572
+ METHODS
573
+ Sample design. The sample employed has been grown by combining MOVPE and MBE
574
+ growth. A schematic view of the sample structure is depicted in Fig. 1a. Starting with MOVPE,
575
+ the heterostructure was grown on a (100)-oriented n+-doped GaAs substrate, starting with a
576
+ 15
577
+
578
+ 300 nm thick n+-doped GaAs layer followed by 29 n+-doped pairs of Al0.95Ga0.05As (77 nm) and
579
+ GaAs (64 nm) forming the bottom DBR. The MOVPE growth is completed with a last layer of
580
+ Al0.95Ga0.05As and a thinner GaAs (31 nm) layer, both n+-doped. From this point on the sample is
581
+ shipped in atmospheric conditions to continue the growth with MBE. After careful oxide removal,
582
+ the gate contact is formed by a 28 nm thick GaAs (n+, 2×1018 cm−3) layer and then followed by
583
+ one (additional) GaAs/AlAs DBR pair. 134.5 nm thick Al0.34Ga0.66As functions as the current
584
+ blocking layer and enables an electrostatic potential across the optically active region. After 5 nm
585
+ of undoped GaAs functioning as spacer, the electron wetting layer state-free self-assembled InAs
586
+ QDs [37] are grown in the Stranski-Krastanow mode with a subsequent flushing step. The result-
587
+ ing QD ensemble luminescence is peaked around 910 nm. Tunnel coupling of the QDs with the
588
+ Fermi sea is realized by a succeeding 35 nm thick GaAs tunnel barrier. In order to reach the back
589
+ contact in a later step, an etch stop layer is added consisting of 1 nm GaAs followed by 1.5 nm
590
+ AlAs and 41 nm GaAs in growth direction. To further increase the extraction of photons, four
591
+ more undoped GaAs/AlAs DBRs are deposited. The sample is completed by an 78nm etch stop
592
+ layer follwoed by the 64,25nm tick GaAs cap.
593
+ The utilized device shows a QD density of 0.1 − 1 · 106 cm−2 of QDs emitting in the wavelength
594
+ range between 899 nm and 911 nm as measured by µ-PL maps. After metallizing the highly
595
+ doped substrate with a chromium-gold alloy, silver epoxy glue is used to contact the gate to the
596
+ chip carrier. In order to apply a voltage to the n++- doped top layer, UV photolithography and
597
+ wet-chemical etching are used to provide access to the back contact, leaving unaffected the DBRs
598
+ on top of the investigated QDs. Alternating wet-chemical etching using citric acid with hydrogen
599
+ peroxide (H2O2) is employed to remove the GaAs layers, and hydrochloric acid (HCl) deluted
600
+ with deionized water to remove the AlAs layers. For contacting the back contact a titanium-
601
+ platinum-gold alloy is deposited via electron-beam physical vapor deposition and subsequently
602
+ wire-bonded with a 150 µm diameter In wire.
603
+ Experimental configuration. Above barrier (AB) and resonant fluorescence (RF) pumping
604
+ are achieved via a continuous wave diode laser and a Ti:sapphire pulsed laser system respectively.
605
+ The sample is placed inside a closed-cycle He cryostat (Montana Instruments, Cryostation s50)
606
+ and kept at a temperature of T = 6K. The excitation and light extraction is accomplished via
607
+ a confocal microscopy setup, with the microscope objective located inside the cryostat. For RF
608
+ detection, a cross-polarization setup is employed (suppression ∼ 107) [38]. The signal is filtered
609
+ 16
610
+
611
+ utilizing a monochromator based on a transmission grating with a spectral resolution of ∼ 15GHz.
612
+ PCFS and TPI measurements were carried out with high efficiency (ηSPAD = 30%) single-photon
613
+ avalanche diodes (SPAD) with a temporal resolution of ∆τSPAD = 350ps. The detectors utilized in
614
+ the lifetime measurements had a higher temporal resolution (∆τSPAD = 50ps) at a cost of reduced
615
+ efficiency (ηSPAD = 2%).
616
+ Ti-sapphire laser. For the pulsed resonant excitation of the QDs, a Coherent Mira Ti:sapphire
617
+ laser was utilized. The laser creates pulses of ≈ 3ps with a repetition rate of 76.2MHz. For the
618
+ PCFS measurements, this rate is amplified (×4) to 304.8MHz.
619
+ Fabry-Perot interferometer and analysis.
620
+ The FPI utilized in the measurements has a
621
+ free spectral range of 15 GHz and a resolution of 100MHz (extracted from the width of the
622
+ SR function). The data in Fig. 1f were fit with a Voigt function convolved with the measured
623
+ SR function. The Voigt profile includes homogeneous and inhomogeneous contributions: with
624
+ the reasonable assumption that the homogeneous linewidth can be extracted from the decay
625
+ time measurement of the trion line (τdec = (652±5) ps, yielding a homogeneous linewidth of
626
+ ∆νhomo = (250±20) MHz), this contribution is kept fixed, while the inhomogeneous broadening
627
+ is left as free fitting parameter.
628
+ Photon-correlation Fourier spectroscopy. PCFS employs a Mach-Zehnder interferometers
629
+ where both exits of the beamsplitter are collected, measured by single-photon counting modules
630
+ and time correlated. In our experiment the translation stage was moved up to 372 mm path dif-
631
+ ference, whereas every 4 mm path difference a correlation measurement was carried out with a
632
+ scanning rate of ∼ 10fringess−1. The consequential frequency resolution in the spectral correla-
633
+ tion is 806 MHz. As this emitter shows close-to lifetime-limited linewidth, a Lorentzian lineshape
634
+ is assumed for the analysis. Under this assumption, the frequency resolution for the measured
635
+ spectrum is increased by a factor of two to 403 MHz. The maximum spectral range covered in
636
+ this framework is 37.5 GHz. The excitation rate of 304.8MHz would allow a temporal resolution
637
+ of ∼ 3ns. However, the current temporal resolution is limited to ∼ 10ns, as the required small
638
+ bin width at these short timescales drastically inflates the statistical error. At timescales reaching
639
+ the scanning rate of the translation stage artifacts of the selfsame distort the signal. The temporal
640
+ upper bound is therefore set to ∼ 10ms.
641
+ 17
642
+
643
+ Two-photon interference. The experiment is performed with an unbalanced Mach-Zehnder
644
+ interferometer (MZI) operating with variable time separations of τMZI = 2, 4 and 9ns.
645
+ 18
646
+
9tE1T4oBgHgl3EQf8AWv/content/tmp_files/load_file.txt ADDED
The diff for this file is too large to render. See raw diff
 
ANAzT4oBgHgl3EQf_v-e/content/tmp_files/2301.01953v1.pdf.txt ADDED
@@ -0,0 +1,1582 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Learning Trajectory-Word Alignments for Video-Language Tasks
2
+ Xu Yang1
3
+ Zhangzikang Li1,2
4
+ Haiyang Xu2*
5
+ Hanwang Zhang3
6
+ Qinghao Ye2
7
+ Chenliang Li2
8
+ Ming Yan2
9
+ Yu Zhang1*
10
+ Fei Huang2
11
+ Songfang Huang2
12
+ 1Southeast University
13
+ 2Alibaba Group
14
+ 3Nanyang Technological University
15
+ {xuyang palm, zhang yu}@seu.edu.cn, lizhangzikang@gmail.com, {shuofeng.xhy, yeqinghao.yqh,
16
+ lcl193798, ym119608, f.huang, songfang.hsf}@alibaba-inc.com, hanwangzhang@ntu.edu.sg
17
+ Abstract
18
+ Aligning objects with words plays a critical role in
19
+ Image-Language BERT (IL-BERT) and Video-Language
20
+ BERT (VDL-BERT). Different from the image case where
21
+ an object covers some spatial patches, an object in a video
22
+ usually appears as an object trajectory, i.e., it spans over
23
+ a few spatial but longer temporal patches and thus con-
24
+ tains abundant spatiotemporal contexts.
25
+ However, mod-
26
+ ern VDL-BERTs neglect this trajectory characteristic that
27
+ they usually follow IL-BERTs to deploy the patch-to-word
28
+ (P2W) attention while such attention may over-exploit triv-
29
+ ial spatial contexts and neglect significant temporal con-
30
+ texts.
31
+ To amend this, we propose a novel TW-BERT
32
+ to learn Trajectory-Word alignment for solving video-
33
+ language tasks. Such alignment is learned by a newly de-
34
+ signed trajectory-to-word (T2W) attention. Besides T2W at-
35
+ tention, we also follow previous VDL-BERTs to set a word-
36
+ to-patch (W2P) attention in the cross-modal encoder. Since
37
+ T2W and W2P attentions have diverse structures, our cross-
38
+ modal encoder is asymmetric. To further help this asymmet-
39
+ ric cross-modal encoder build robust vision-language as-
40
+ sociations, we propose a fine-grained “align-before-fuse”
41
+ strategy to pull close the embedding spaces calculated by
42
+ the video and text encoders. By the proposed strategy and
43
+ T2W attention, our TW-BERT achieves SOTA performances
44
+ on text-to-video retrieval tasks, and comparable perfor-
45
+ mances on video question answering tasks with some VDL-
46
+ BERTs trained on much more data. The code will be avail-
47
+ able in the supplementary material.
48
+ 1. Introduction
49
+ By witnessing the boom of BERT-like models in single
50
+ domains, e.g., vision or language [20, 44, 51], researchers
51
+ begin to build vision-language BERTs [3, 9, 61] for learn-
52
+ ing robust cross-modal associations. Compared with the
53
+ *Corresponding authors.
54
+ A boy is playing basketball.
55
+ (a) RoI based IL-BERT
56
+ (b) Patch based IL-BERT
57
+ (c) Patch based VDL-BERT
58
+ (d) TW-BERT
59
+ Figure 1. The comparisons of four different ways to build object-
60
+ word alignments. In (b), by patch-to-word (P2W) attention, im-
61
+ plicitly object-word alignment can be built, e.g., the “ball region”
62
+ is aligned with basketball. While in (c), P2W attention may con-
63
+ centrate the attention of an object on only one frame, e.g., basket-
64
+ ball only attends over on the “ball region” of the first frame. (d)
65
+ By TW-BERT, the trajectory of an object is constructed, e.g., the
66
+ “ball trajectory” through 4 frames is built.
67
+ images, videos provide more details for building robust as-
68
+ sociations, e.g., the spatiotemporal contexts in videos can
69
+ better describe the actions. However, directly addressing
70
+ dynamic videos may cost more storage and computation re-
71
+ sources. To circumvent such huge cost, researchers first
72
+ study image-language BERT (IL-BERT) [7, 16, 24, 26, 61]
73
+ and then exploit the research fruits to build the challeng-
74
+ ing, while more pragmatic, video-language BERT (VDL-
75
+ BERT) [2,12,25,32–34,46,47,53].
76
+ 1
77
+ arXiv:2301.01953v1 [cs.CV] 5 Jan 2023
78
+
79
+ Pioneering techniques are directly inherited from IL-
80
+ BERT into VDL-BERT, e.g., the image encoders are used
81
+ to embed sampled video frames [22, 62]. However, since
82
+ image encoders can hardly learn temporal contexts, the re-
83
+ sultant VDL-BERTs will degrade to IL-BERT even if they
84
+ are trained by video-text pairs. To ameliorate it, researchers
85
+ apply the video encoders [4,11,23,29] to embed spatiotem-
86
+ poral contexts. Though promising improvements are ob-
87
+ served, these VDL-BERTs still neglect or ill-consider a
88
+ significant factor in IL-BERT: the object-word alignment,
89
+ which helps learn robust associations.
90
+ Aligning the visual objects with the semantic knowledge
91
+ lays the foundation of humans’ visual reasoning and so does
92
+ the AI agent.
93
+ To learn object-word alignments, as Fig-
94
+ ure 1(a) shows, researchers use an RoI-based extractor to
95
+ embed an image into a series of RoI features and train the
96
+ model by predicting the masked RoI categories based on
97
+ the paired texts [7,26,31]. However, this RoI-based extrac-
98
+ tor is offline trained by object detection with limited label
99
+ inventory, which will weaken the IL-BERT since the ex-
100
+ tractor will not be updated during large-scale pre-training.
101
+ To enable the end-to-end training, researchers substitute the
102
+ RoI-based extractor with visual transformers whose outputs
103
+ are a series of grid embeddings, which will be used to build
104
+ the cross-modal connections. Although a single grid usu-
105
+ ally does not construct an integral object, fortunately, the
106
+ widely applied patch-to-word (P2W) attention of IL-BERT
107
+ can softly seek the salient visual regions for a given query
108
+ word. Then the object-word alignments can still be built
109
+ between this softly detected object and the word, e.g., as
110
+ shown in Figure 1(b), the object “boy” and “basketball” can
111
+ be implicitly attended by the corresponding word queries.
112
+ Although the P2W attention remedies the loss of RoI-
113
+ level features for learning object-word alignments in IL-
114
+ BERT, its effectiveness is weakened in the video case. This
115
+ is because the objects usually act as the Trajectories which
116
+ span a few spatial while multiple temporal grids in the
117
+ videos.
118
+ Thus, directly applying the P2W attention may
119
+ over-exploit the trivial spatial contexts while neglecting the
120
+ significant temporal contexts and then make the model at-
121
+ tend to only one or two frames.
122
+ Figure 1(c) shows this
123
+ limitation that P2W attention only aligns the “ball” in the
124
+ first frame to the word ball. To address this limitation, we
125
+ propose to build Trajectory-to-Word alignments to solve
126
+ video-language tasks and name this model as TW-BERT.
127
+ Specifically, such alignment is learnt by a novel designed
128
+ trajectory-to-word T2W attention, which first uses the word
129
+ as the query to seek the salient parts of each frame and the
130
+ sought parts are sequenced to form the trajectory. Then the
131
+ query word attends over the trajectories again for captur-
132
+ ing cross-modal associations. In this way, the trivial spa-
133
+ tial regions are weakened and the temporal contexts will be
134
+ strengthened, e.g., as shown in Figure 1(d), the attention
135
+ weights of the word will be concentrated on the object tra-
136
+ jectory instead of only on one or two frames as in (c).
137
+ For implementation, we follow most VDL-BERTs to set
138
+ up the network: two single-modal encoders for the video
139
+ and text and one cross-modal encoder, which is sketched
140
+ in Figure 2.
141
+ For the cross-modal encoder, we also ap-
142
+ ply a word-to-patch (W2P) attention as previous VDL-
143
+ BERTs [2, 22, 23, 47] to assign a visual patch with certain
144
+ words. Since our T2W attention operates a double atten-
145
+ tion mechanism, which does not have the same structure
146
+ as W2P, our cross-modal encoder is asymmetric. Further-
147
+ more, to help this asymmetric encoder build more robust
148
+ trajectory-word alignments, we apply the align-before-fuse
149
+ strategy [24].
150
+ This strategy learns to pull close the em-
151
+ beddings of paired video-text data output from two single-
152
+ modal encoders. However, different from [24] which uses
153
+ global [CLS] tokens to calculate the coarse-grained con-
154
+ trastive loss, we propose a fine-grained one by summing the
155
+ token-wise maximum similarities between the embeddings
156
+ of the patches and words. In this way, we amplify the influ-
157
+ ences of the local details to avoid the single-modal encoders
158
+ over-exploiting the trivial global background contexts. To
159
+ sum up, our contributions are:
160
+ • We propose a novel perspective to consider the videos
161
+ that the videos are composed of moving object trajec-
162
+ tories, which may inspire the researchers to build more
163
+ advanced VDL-BERTs.
164
+ • We propose a simple while effective T2W attention
165
+ to learn Trajectory-to-Word alignments that extends
166
+ the object-word alignment in the image case, which is
167
+ achieved by patch-word alignment, to the video case.
168
+ • We propose the fine-grained contrastive loss in VDL-
169
+ BERT to exploit more local details to pull close the
170
+ video and word embeddings.
171
+ • We achieve SOTA scores under the condition of using
172
+ the same amount of training data.
173
+ 2. Related Work
174
+ 2.1. Image-Language BERT (IL-BERT)
175
+ Recently, various techniques have been proposed in IL-
176
+ BERT to learn vision-language connections. Most of them
177
+ aim at capturing robust object-word alignments since such
178
+ alignments construct the foundations of visual reasoning.
179
+ In the beginning, a pre-trained Faster-RCNN [41] is used
180
+ to extract a series of RoI poolings, where each one con-
181
+ tains one or a few salient objects, to facilitate building
182
+ object-word alignments [7,26,31,48]. However, this Faster-
183
+ RCNN is usually pre-trained by the object annotations from
184
+ COCO [6] and VG [19], whose concept space is much
185
+ narrower than the data used to train IL-BERT, which can
186
+ be almost unlimitedly collected from the websites. More-
187
+ over, this Faster-RCNN is not updated during the end-to-
188
+ end training of the IL-BERT, which means that the visual
189
+ 2
190
+
191
+ encoder may hardly learn novel knowledge from the web-
192
+ collected data. Thus the performances of these IL-BERTs
193
+ are limited.
194
+ To further release the potential of hugely web-collected
195
+ data, the offline Faster RCNN is switched into vision Trans-
196
+ formers [10, 29] and thus a homogeneous IL-BERT, i.e.,
197
+ all the components are transformer-based, is built, which
198
+ is more easily trained end-to-end [31]. Compared with the
199
+ RoI-based encoder, the vision Transformer outputs a series
200
+ of patch embeddings and thus may lose object-level knowl-
201
+ edge. To remedy such loss, various strategies are proposed
202
+ to improve the vision-language alignments. For example,
203
+ the align-before-fuse strategy [24] aligns the paired image-
204
+ text embeddings before cross-modal fusion for facilitating
205
+ the subsequent fusion.
206
+ And the fine-grained contrastive
207
+ objective [58] amplifies the local details for learning the
208
+ object-word alignments. Motivated by them, in our VDL-
209
+ BERT, we propose a fine-grained align-before-fuse strat-
210
+ egy to make the later asymmetric cross-modal encoder learn
211
+ more robust word-trajectory alignments.
212
+ 2.2. Video-Language BERT (VDL-BERT)
213
+ Since the spatiotemporal contexts in videos can hardly
214
+ be learnt by image extractors, only inheriting the techniques
215
+ which are successful in IL-BERT to VDL-BERT is not
216
+ enough. Thus, based on the fruits of IL-BERT, most VDL-
217
+ BERTs aim at exploiting more spatiotemporal contexts to
218
+ build cross-modal associations. One straightforward way is
219
+ to learn such spatiotemporal contexts through video Trans-
220
+ formers [4, 27]. Besides this, some more advanced tech-
221
+ niques are proposed, e.g., VIOLET [11] tokenizes the dy-
222
+ namic video patches and predicts the labels of these tokens;
223
+ BridgeFormer [13] erases the words (nouns or verbs) from
224
+ the text and learn to match the visual embeddings queried
225
+ by the erased words and the remained texts; or ALPRO [23]
226
+ computes the similarities between the video embeddings
227
+ with the generated entity prompts. Although substantial im-
228
+ provements are observed, these methods use video patches
229
+ in the cross-modal encoder, which neglects that an object
230
+ usually acts as the trajectory in the videos, and thus they
231
+ may over-exploit the trivial spatial contexts. To ameliorate
232
+ this limitation, we propose the Trajectory-Word attention to
233
+ learn more robust vision-language alignment.
234
+ 3. Approach
235
+ Figure 2 sketches TW-BERT, which has two single-
236
+ modal encoders for embedding the video and text (cf.
237
+ Sec. 3.1) and one cross-modal encoder for learning video-
238
+ language associations (cf. Sec. 3.2). Different from the pre-
239
+ vious VDL-BERTs, our cross-modal encoder is an asym-
240
+ metric one that contains a classic word-to-patch (W2P) at-
241
+ tention and a novel proposed trajectory-to-word (T2W) at-
242
+ tention (cf.
243
+ Sec. 3.2) for learning trajectory-word align-
244
+ Text
245
+ Encoder
246
+ Video
247
+ Encoder
248
+ [CLS]
249
+ A
250
+ boy
251
+ is
252
+ playing
253
+ basketball
254
+ Video
255
+ Encoder
256
+ Video
257
+ Encoder
258
+ Video
259
+ Encoder
260
+ Lc
261
+ Trajectory-to-Word
262
+ Attention
263
+ Word-to-Patch
264
+ Attention
265
+
266
+
267
+
268
+
269
+
270
+ Asymmetric
271
+ Cross-modal
272
+ Encoder
273
+ Lf
274
+ Lvtm
275
+ Lmlm
276
+ [CLS]
277
+ [CLS]
278
+ Figure 2. The architecture of TW-BET, which contains two single-
279
+ modal encoders and one asymmetric cross-modal encoder. Totally
280
+ four losses in the green blocks are used to train the whole model:
281
+ coarse-/ fine-grained contrastive losses Lc/Lf, Lmlm, and Lvtm.
282
+ ments. To further encourage the cross-modal encoder to
283
+ learn such alignments, we propose a fine-grained align-
284
+ before-fuse strategy which amplifies the local details to help
285
+ single-modal encoders pull close the embeddings of paired
286
+ video-texts (cf. Sec. 3.3).
287
+ 3.1. Single-Modal Encoders
288
+ Video Encoder.
289
+ For a video, we sample 4 224 × 224
290
+ frames and input them into the 12-layer TimeSformer [4,23]
291
+ for embedding.
292
+ TimeSformer first partitions each frame
293
+ into 14 × 14 non-overlapping patches, which are flattened
294
+ and fed to a linear projection layer to produce a sequence
295
+ of patch tokens. Then TimeSformer applies self-attention
296
+ along the temporal and spatial dimensions to calculate per-
297
+ frame features.
298
+ These features are further mean-pooled
299
+ along the height and width dimensions. Learnable spatial
300
+ positional embeddings are added to each video token in the
301
+ same spatial location of different frames. The final out-
302
+ put embedding set is V
303
+ = {vcls, v1, ..., vNV −1}, where
304
+ vn ∈ Rd and vcls is the global [CLS] embedding.
305
+ Text Encoder. For a text, we use a 6-layer transformer to
306
+ embed it and the output is X = {xcls, x1, ..., xNX−1},
307
+ where xn ∈ Rd and xcls is the global [CLS] embedding.
308
+ Similar to the video encoder, we also add positional embed-
309
+ dings to the text tokens.
310
+ 3.2. Asymmetric Cross-Modal Encoder
311
+ After embedding videos and texts, a cross-modal en-
312
+ coder is used to fuse them by calculating bi-directional as-
313
+ sociations: vision-to-language and language-to-vision. No
314
+ matter what the direction is, the motivation is to assign
315
+ semantic knowledge from one domain to another. Since
316
+ a single word contains integral semantic knowledge, we
317
+ follow previous VDL-BERT [2, 22, 23, 47] to set a tradi-
318
+ tional word-to-patch (W2P) attention to assign the words to
319
+ a patch. However, different from the word, only the object
320
+ instead of one grid conveys integral semantic knowledge.
321
+ 3
322
+
323
+ Time
324
+ Time
325
+ (a): Patch-to-Word Attention
326
+ (b): Trajectory-to-Word Attention
327
+ Figure 3. The comparisons between Patch-to-Word (P2W) and
328
+ Trajectory-to-Word (T2W) attentions, where the green block de-
329
+ notes a query word and the blue blocks denote the video patches.
330
+ In P2W attention, the word attends over all the video patches and
331
+ may only concentrate on one frame, while in T2W attention, the
332
+ salient parts of each frame are found to construct a trajectory,
333
+ which is connected by the green line.
334
+ In videos, an object usually spans both spatial and tempo-
335
+ ral axes and thus the previously used patch-to-word (P2W)
336
+ attention may fail to transfer the semantic knowledge. To
337
+ amend this, we design a novel Trajectory-to-Word (T2W)
338
+ attention for transferring semantic knowledge from videos
339
+ to texts. Since W2P and T2W attentions have diverse struc-
340
+ tures, our cross-encoder is asymmetric.
341
+ Specifically, both W2P and T2W attentions are built on
342
+ the Multi-Head Attention (MHA) operation, here we first
343
+ formalize MHA and then introduce how to use it to build
344
+ W2P and T2W attentions. Formally, MHA is*:
345
+ Input:
346
+ Q, K, V
347
+ Att:
348
+ Ai = Softmax(QWQ
349
+ i (KWK
350
+ i )T
351
+
352
+ d
353
+ )
354
+ Head :
355
+ Hi = AiVWV
356
+ i ,
357
+ Multi-Head:
358
+ H = [H1, H2, ..., Hh]WH,
359
+ Output:
360
+ Z = LN(H + Q),
361
+ (1)
362
+ where WQ
363
+ i , WK
364
+ i , WV
365
+ i , WH
366
+ i
367
+ are all trainable matrices; h is
368
+ the head number and dh = d/h; Ai is the i-th attention
369
+ matrix corresponding to the i-th head matrix; [·] is the con-
370
+ catenation operation; and LN is the Layer Normalization.
371
+ Word-to-Patch (W2P) Attention. To calculate the W2P
372
+ alignment, we apply the conventional W2P attention [23]:
373
+ ZW 2P = MHA(Q = V , K = V = X),
374
+ (2)
375
+ where V ∈ RNV ×D, X ∈ RNX×D are respectively video
376
+ and word embedding sets got from two single-modal en-
377
+ coders. By setting the query Q to the video patch embed-
378
+ dings, Eq. (2) learns to assign suitable words to each video
379
+ patch and thus captures the W2P alignment.
380
+ Trajectory-to-Word (T2W) Attention. We propose the
381
+ T2W attention that uses two steps to learn the T2W align-
382
+ ment: it first constructs a trajectory for a given word and
383
+ then uses the word as the query to attend over the trajec-
384
+ tory for capturing the associations. For convenience, we
385
+ *To avoid symbol confusions, we use the calligraphic font (\mathcal
386
+ commend in LaTex) to denote the built-in variables of the MHA module.
387
+ Fine-Grained Word Patch Assignments
388
+ Figure 4. For each word token xm, a corresponding video patch
389
+ v∗
390
+ m that has the maximum inner product with xi is found, which
391
+ is indexed by the same color.
392
+ introduce how the T2W attention calculates the fusion em-
393
+ bedding zT 2W for a single word x and it is straightforward
394
+ to extend it to a sequence of the words.
395
+ In the first step, T2W attention uses x as the query to
396
+ find the salient parts for each frame and then sequence these
397
+ parts to construct the trajectory. Assuming Vt is the embed-
398
+ ding set of the t-th frame, the salient part yt is got as:
399
+ yt = MHA(Q = x, K = V = Vt).
400
+ (3)
401
+ Then the salient parts at different time frames construct a
402
+ continuous flow Y = {y1, ..., yT }, which is the trajectory
403
+ of the given word.
404
+ In the second step, to get the trajectory-to-word fusion
405
+ embedding zT 2W , we treat x as the query again while using
406
+ the trajectory Y as the key and value in MHA:
407
+ zT 2W = MHA(Q = x, K = V = Y ).
408
+ (4)
409
+ By Eq. (3), T2W attention finds the salient parts for the
410
+ given word at each frame, which enforces Eq. (4) to attend
411
+ over the continuous frames instead of concentrating the at-
412
+ tention only on one or some episodic frames as the previous
413
+ P2W attentions. In this way, the whole T2W block exploits
414
+ more temporal contexts to build vision-language associa-
415
+ tions, which facilitates the video reasoning tasks that usu-
416
+ ally require the correct recognition of the temporal patterns.
417
+ Figure. 3 compares P2W and T2W attentions.
418
+ 3.3. Fine-Grained Align-Before-Fuse
419
+ Align-before-fuse strategy [24] pulls close vision and
420
+ language embedding spaces calculated by two single-modal
421
+ encoders, which encourages the subsequent cross-modal
422
+ encoder to build more robust semantic associations. Mo-
423
+ tivated by this, we apply this strategy for helping our asym-
424
+ metric cross-modal encoder learn better connections. This
425
+ strategy contrasts the outputs of two single-modal encoders
426
+ by maximizing the similarity of the paired video-text em-
427
+ beddings and minimizing the similarity if they are not
428
+ paired. Suppose sij denotes the similarity score of the i-
429
+ 4
430
+
431
+ th video and the j-th text, then the contrastive objective is:
432
+ Lc = −
433
+
434
+ i
435
+ log
436
+ exp(sii/τ)
437
+
438
+ j exp(sij/τ) −
439
+
440
+ j
441
+ log
442
+ exp(sjj/τ)
443
+
444
+ i exp(sij/τ), (5)
445
+ where τ is the temperature. This loss contains two symmet-
446
+ ric parts, where the left term forces the i-th text embedding
447
+ to be close to the i-th video embedding compared with the
448
+ other texts and the right term has a similar effect.
449
+ The seminal research [24] computes sij by the image and
450
+ text global [CLS] tokens, which only capture the coarse-
451
+ level contexts. However, the critical visual patterns (e.g.,
452
+ the salient objects) only occupy small parts of the image,
453
+ which may be neglected by the global [CLS] token since
454
+ it mean-pools the whole image. Such limitation will be fur-
455
+ ther exacerbated in the videos since the videos contain more
456
+ trivial spatial backgrounds, which may be over-exploited by
457
+ the coarse-level contrastive loss. Then the models trained
458
+ by this loss will fail in distinguishing the videos that have
459
+ similar backgrounds while containing diverse events.
460
+ To amend this limitation, we propose the fine-grained
461
+ align-before-fuse strategy which calculates sij by summing
462
+ the token-wise maximum similarities between the patch and
463
+ the word embeddings. In this way, local details will be am-
464
+ plified to pull close the embedding spaces for helping the
465
+ subsequent cross-modal encoder build more robust associa-
466
+ tions. It requires two steps to get fine-grained sij. Firstly,
467
+ for each video patch embedding vn, we find the word em-
468
+ bedding x∗
469
+ n which has the maximum inner product with vn:
470
+ x∗
471
+ n = argmax
472
+ xm∈X
473
+ vT
474
+ n xm,
475
+ (6)
476
+ where X is the word embedding set. By Eq. (6), a most cor-
477
+ responding word will be assigned to the given video patch.
478
+ Secondly, after finding the maximum similarity word for
479
+ each patch, we calculate the token-wise video-to-text simi-
480
+ larity score sv as:
481
+ sv =
482
+
483
+ n
484
+ vT
485
+ n x∗
486
+ n.
487
+ (7)
488
+ Similarly, we can calculate the text-to-video one st as:
489
+ st =
490
+
491
+ m
492
+ xT
493
+ mv∗
494
+ m,
495
+ (8)
496
+ where v∗
497
+ m is the video patch which has the maximum inner
498
+ product corresponding to the word xm, which is sketched
499
+ in Figure. 4.
500
+ Lf = −
501
+
502
+ i
503
+ log
504
+ exp(sv
505
+ ii/τ)
506
+
507
+ j exp(sv
508
+ ij/τ)−
509
+
510
+ j
511
+ log
512
+ exp(st
513
+ jj/τ)
514
+
515
+ i exp(st
516
+ ij/τ), (9)
517
+ 3.4. Training Objectives
518
+ To train TW-BERT, as the green blocks shown in Fig-
519
+ ure 2, we totally use four losses which are masked language
520
+ modeling (MLM), video-text matching (VTM), coarse-
521
+ grained video-text contrastive loss and the novel proposed
522
+ fine-grained video-text contrastive loss.
523
+ Masked language Modeling (MLM) [11,23,25,50]. MLM
524
+ aims to predict the masked word tokens given both the video
525
+ and the text contexts. To get it, we first randomly replace
526
+ the input text tokens with the [MASK] token with a proba-
527
+ bility of 15% and then use the [MASK] embedding output
528
+ from the cross-modal encoder to predict the masked word
529
+ by calculating a cross-entropy loss.
530
+ Video-text Matching (VTM) [11,23,50]. VTM calculates
531
+ whether the given video and text are matched or not. To get
532
+ it, for a given video-text pair, we first randomly replace the
533
+ text with the ones from a different video in the same batch.
534
+ Then we concatenate the video and text [CLS] embeddings
535
+ output from the cross-modal encoder and input the concate-
536
+ nated embedding into a binary classifier to judge whether
537
+ the given video-text pair is matched or not.
538
+ Video-text Contrastive (VTC) [2, 13, 14, 23, 49, 50]. As
539
+ detailed in Section 3, VTC contrasts the outputs of two
540
+ single-modal encoders to pull close their embedding space
541
+ to help the subsequent cross-modal encoder build more
542
+ robust vision-language associations. It contains both the
543
+ coarse-grained (Eq. (5)) and fine-grained (Eq. (9)) terms:
544
+ Lvtc = Lc + Lf.
545
+ (10)
546
+ In the implementation, we follow [24] to use the momentum
547
+ queue as a continuously-evolving teacher to provide more
548
+ negative samples.
549
+ 4. Experiments
550
+ 4.1. Pre-training Dataset
551
+ Following recent work [2, 13, 14, 23, 49], we pre-train
552
+ TW-BERT on Google Conceptual Captions (CC3M) [45]
553
+ containing 3.3M image-text pairs and WebVid-2M [2] con-
554
+ taining 2.5M video-text pairs.
555
+ For CC3M, the image
556
+ is treated as a one-frame video data during pre-training.
557
+ Note that due to the limited storage and computation re-
558
+ sources, we do not use some much larger datasets like
559
+ HowTo100M [35] containing 136M video-text pairs as [25,
560
+ 54].
561
+ Also, we do not distil knowledge from CLIP [39],
562
+ which is pre-trained on 400M image-text pairs, as [33].
563
+ 4.2. Downstream Tasks
564
+ Text-to-Video Retrieval.
565
+ (i) MSRVTT contains 10K
566
+ YouTube videos with 200K descriptions. We follow [55] to
567
+ use 9K train+val videos for training and report results on the
568
+ 1K test split. (ii) DiDeMo [15] contains 10K Flickr videos
569
+ annotated with 40K sentences. (iii) LSMDC consists of
570
+ 118,081 video clips sourced from 202 movies, where the
571
+ validation set and the test set contain 7,408 and 1,000
572
+ videos. (iv) ActivityNet Caption contains 20K YouTube
573
+ videos annotated with 100K sentences.
574
+ The training set
575
+ contains 10K videos, and we use val1 set with 4.9K videos
576
+ to report results. For MSRVTT and LSMDC, we perform
577
+ standard text-to-video retrieval. For DiDeMo and Activi-
578
+ 5
579
+
580
+ tyNet Caption, we concatenate all the text captions in the
581
+ same video as a single query and evaluate paragraph-to-
582
+ video retrieval.
583
+ For two tasks, we measures the perfor-
584
+ mances by average recall at K(R@K) and Median Rank on
585
+ zero-shot and fine-tune setups.
586
+ Video Question Answering. (i) MSRVTT-QA [52] is built
587
+ upon videos and captions from MSRVTT [55], which con-
588
+ tains 10K videos with 243K open-ended questions and 1.5K
589
+ answer candidates. (ii) MSVD [5] contains 50K question-
590
+ answer pairs with 2423 answer candidates. We use standard
591
+ train/val/test splits for the two tasks, and report accuracy.
592
+ 4.3. Implementation Details
593
+ We initialize our video encoder by ViT-B/16 [42] and
594
+ the text encoder by the first six BERT-Base layers [8]. For
595
+ the cross-modal encoder, the self-attentions in all 3 cross-
596
+ modal attentions (W2P contains 1 and T2W contains 2) are
597
+ initialized by the last 6 BERT-Base layers [8]. The model is
598
+ trained end-to-end during both pre-training and fine-tuning.
599
+ In pre-training, the feature dimension is set to 256 when
600
+ calculating the contrastive losses and the temperature is set
601
+ to 0.05. For the momentum queue, the momentum value
602
+ is 0.995 and the size of the queue is 65,536. The above
603
+ implementation details follow the recent work [23, 24] for
604
+ a fair comparison. We pre-train the model on CC3M and
605
+ WebVid-2M for 10 epochs on 8 NVIDIA A100 GPUs
606
+ where the batch size is 128. We use AdamW [17] optimizer
607
+ with a weight decay of 0.001 and betas (0.9, 0.98). The
608
+ learning rate is first warmed-up to 1e-4 and then decays fol-
609
+ lowing a linear decay schedule.
610
+ During fine-tuning text-to-video retrieval, we sample 8
611
+ frames per video. The model is trained with both VTC and
612
+ VTM losses, and we obtain similarity scores from the out-
613
+ put of the VTM head during inference. For video ques-
614
+ tion answering, we sample 16 frames per video.
615
+ Since
616
+ MSRVTT-QA and MSVD-QA [52] are open-ended VQA,
617
+ in which the answers are in free-form natural language, it is
618
+ common to convert the task to a classification task by pre-
619
+ dicting the answer’s label. We input the concatenation of the
620
+ video and question [CLS] tokens into a two-layer MLP [8]
621
+ for calculating the cross-entropy loss. All the fine-tuning
622
+ experiments are conducted on 8 NVIDIA V100 GPUs.
623
+ 4.4. Ablation Studies
624
+ We conduct comprehensive ablation studies to evaluate
625
+ the effectiveness of the proposed trajectory-to-word (T2W)
626
+ attention, concatenation strategy, and fine-grained align-
627
+ before-fuse (FG-ABF) strategy.
628
+ Comparing Methods. Base: We use a symmetric cross-
629
+ modal encoder that contains patch-to-word (P2W) and
630
+ word-to-patch (W2P) attentions. T2W: We replace P2W
631
+ attention in Base by our T2W attention. ConCat: Since our
632
+ cross-modal encoder is asymmetric, we concatenate the text
633
+ and video [CLS] tokens to calculate the VTM loss, which is
634
+ different from the symmetric ones [11,23,49] that only use
635
+ text [CLS] token. TW-BERT: We additionally apply fine-
636
+ grained align-before-fuse to the baseline ConCat and then
637
+ the integral TW-BERT is built.
638
+ Quantitative Results. Table 1 compares the performances
639
+ of diverse baselines. From this table, we can see that T2W
640
+ outperforms Base, e.g., T2W achieves 1.5% R@5 improve-
641
+ ments on MSRVTT for zero-shot evaluation, which sug-
642
+ gests that our T2W attention can exploit more temporal con-
643
+ texts to better solve video-language tasks. Also, ConCat is
644
+ better than T2W on different tasks, e.g., ConCat achieves
645
+ 28.0% of R@1 score in DiDeMo zero-shot text-to-video re-
646
+ trieval task while T2W only has 27.4%. This proves that the
647
+ concatenation strategy is effective in this asymmetric cross-
648
+ modal encoder case.
649
+ Lastly, we can see that TW-BERT
650
+ also beats Concat by using the fine-grained align-before-
651
+ fuse strategy, e.g., TW-BERT achieves 1.6% of R@5 im-
652
+ provements on MSRVTT for zero-shot evaluation, which
653
+ validates the power of this strategy.
654
+ Qualitative Results. We visualize the heat maps of the at-
655
+ tention weights of Base and TW-BERT in Figure 5. We see
656
+ that TW-BERT can implicitly form a trajectory for a given
657
+ query word to avoid over-exploiting the trivial spatial con-
658
+ texts as in Base. For example, in (a), TW-BERT tracks the
659
+ hand of the girl in each frame according to the query word
660
+ “practising” while Base attends to the larger while trivial
661
+ regions about the whole body of the girl. Moreover, in (b),
662
+ the trajectory of the ball is tracked by the query “basketball”
663
+ while Base only focuses on the ball region in the first frame.
664
+ 4.5. Comparisons with SOTA
665
+ We compare our TW-BERT with previous methods on
666
+ two frequently applied tasks which are video-text retrieval
667
+ (VDTR) and video question answering (VDQA). Table 2
668
+ and 3 report the performances of VDTR on MSRVTT [55],
669
+ DiDeMo [15], LSMDC [43], and ActivityNet Caption [18],
670
+ respectively, where the former three datasets contain both
671
+ zero-shot and fine-tuning setups and the last one only
672
+ has fine-tuning setup.
673
+ Table 4 reports the VDQA on
674
+ MSRVTT [55] and MSVD [5].
675
+ Among the compared
676
+ models, MILES [14], BridgeFormer [13], OA-Trans [49],
677
+ Clipbert [22] and VIOLET [11] are SOTA models pro-
678
+ posed in recently 1-2 years. Note that VIOLET [11] and
679
+ ALPRO [23] distill knowledge from additional large-scale
680
+ BERTs while we do not. Also, we show the number of pre-
681
+ training video-text pairs in these tables for more clear com-
682
+ parisons.
683
+ From these tables, we can find that when the pre-training
684
+ data is in the same scale, TW-BERT achieves the best
685
+ performance compared with all the other models on both
686
+ VDTR and VDQA. For example, on DiDeMo VDTR, TW-
687
+ BERT outperforms BridgeFormer by 4.8% on R@1, or on
688
+ 6
689
+
690
+ (b) “Two people play basketball”
691
+ (a) “A girl practising her arrow tricks”
692
+ (c) “Adult feeds baby with spoon”
693
+ (d) “The dog runs away and picks up the cone”
694
+ Video
695
+ Frames
696
+ Base
697
+ TW-BERT
698
+ Video
699
+ Frames
700
+ Base
701
+ TW-BERT
702
+ Figure 5. Visualizations of the attention maps from cross-modal encoder. Sample (a) and (b) are from MSRVTT [55], (c) and (d) are from
703
+ DiDeMo [15] retrieval dataset. TW-BERT attends to the patches related to given query word by Trajectory-to-Word attention.
704
+ Table 1. Performances of various baselines. R@K and MedR respectively denote recall (%) with K retrieval efforts and median ranking
705
+ for retrieved videos where higher R@K and lower MedR indicate better performance.
706
+ Method
707
+ MSRVTT-ZS
708
+ DiDeMo-ZS
709
+ MSVD-QA
710
+ R@1↑
711
+ R@5↑
712
+ R@10↑
713
+ MedR↓
714
+ R@1↑
715
+ R@5↑
716
+ R@10↑
717
+ MedR↓
718
+ Acc.
719
+ Base
720
+ 25.1
721
+ 46.4
722
+ 57.3
723
+ 7.0
724
+ 26.6
725
+ 52.8
726
+ 62.7
727
+ 5.0
728
+ 47.4
729
+ T2W
730
+ 25.8
731
+ 47.9
732
+ 58.0
733
+ 6.0
734
+ 27.4
735
+ 53.1
736
+ 64.0
737
+ 5.0
738
+ 48.1
739
+ ConCat
740
+ 26.1
741
+ 48.5
742
+ 58.6
743
+ 6.0
744
+ 28.0
745
+ 52.9
746
+ 64.2
747
+ 4.0
748
+ 48.3
749
+ TW-BERT
750
+ 26.4
751
+ 50.1
752
+ 59.6
753
+ 5.0
754
+ 28.4
755
+ 52.9
756
+ 64.5
757
+ 4.0
758
+ 48.5
759
+ MSVD VDQA, TW-BERT outperforms ALPRO by 2.6%.
760
+ Moreover, compared with the models trained on much more
761
+ data, TW-BERT can still achieve the best performances on
762
+ various tasks, e.g., on LSMDC VDTR, TW-BERT outper-
763
+ forms VIOLET by 8.0% on R@10 or on MSRVTT VDQA,
764
+ TW-BERT outperforms MERLOT [59] by 0.5%.
765
+ Note that the videos in LSMDC are longer than
766
+ MSRVTT and DiDeMo, which means that the videos in
767
+ this dataset contain more temporal contexts than the other
768
+ datasets. Then as shown in Table 2, the improvements of
769
+ TW-BERT over other SOTAs are larger than the improve-
770
+ ments on the other datasets. For example, compared with
771
+ BridgeFormer, TW-BERT has an average 3.4% improve-
772
+ ment in the zero-shot setting, while on DiDeMo dataset, the
773
+ corresponding average improvement over MILES is only
774
+ 1.6%. Such comparisons further validate the effectiveness
775
+ of TW-BERT in exploiting temporal contexts.
776
+ Among these SOTAs, only when compared with VIO-
777
+ LET, which uses an additional large-scale model DALL-
778
+ E [40] and 32 more times pre-training data than ours (180M
779
+ VS. 5.5M), TW-BERT cannot comprehensively surpass VI-
780
+ OLET on all the tasks. For example, on MSRVTT zero-shot
781
+ VDTR, VIOLET achieves 0.1% higher than TW-BERT or
782
+ on MSRVTT VDQA, VIOLET achieves 0.3% higher than
783
+ 7
784
+
785
+ ACARTable 2. Experiments of text-to-video retrieval on MSRVTT, DiDeMo and LSMDC datasets. “#PT Pairs” lists the number of video-text
786
+ pairs for pre-training. We show results with zero-shot evaluation (top) and fine-tuning evaluation (bottom).
787
+ Method
788
+ #PT Pairs
789
+ MSRVTT
790
+ DiDeMo
791
+ LSMDC
792
+ R@1↑
793
+ R@5↑
794
+ R@10↑
795
+ MedR↓
796
+ R@1↑
797
+ R@5↑
798
+ R@10↑
799
+ MedR↓
800
+ R@1↑
801
+ R@5↑
802
+ R@10↑
803
+ MedR↓
804
+ ActBERT [62]
805
+ 120M
806
+ 8.6
807
+ 23.4
808
+ 33.1
809
+ 36.0
810
+ -
811
+ -
812
+ -
813
+ -
814
+ -
815
+ -
816
+ -
817
+ -
818
+ MIL-NCE [35]
819
+ 120M
820
+ 9.9
821
+ 24.0
822
+ 32.4
823
+ 29.6
824
+ -
825
+ -
826
+ -
827
+ -
828
+ -
829
+ -
830
+ -
831
+ -
832
+ TACo [57]
833
+ 120M
834
+ 9.8
835
+ 25.0
836
+ 33.4
837
+ 29.0
838
+ -
839
+ -
840
+ -
841
+ -
842
+ -
843
+ -
844
+ -
845
+ -
846
+ VideoCLIP [54]
847
+ 110M
848
+ 10.4
849
+ 22.2
850
+ 30.0
851
+ -
852
+ 16.6
853
+ 46.9
854
+ -
855
+ -
856
+ -
857
+ -
858
+ -
859
+ -
860
+ SupportSet [37]
861
+ 120M
862
+ 12.7
863
+ 27.5
864
+ 36.2
865
+ 24.0
866
+ -
867
+ -
868
+ -
869
+ -
870
+ -
871
+ -
872
+ -
873
+ -
874
+ HERO [25]
875
+ 120M
876
+ 16.8
877
+ 43.4
878
+ 57.7
879
+ -
880
+ -
881
+ -
882
+ -
883
+ -
884
+ -
885
+ -
886
+ -
887
+ -
888
+ VIOLET [11]
889
+ 186M
890
+ 25.9
891
+ 49.5
892
+ 59.7
893
+ -
894
+ 23.5
895
+ 49.8
896
+ 59.8
897
+ -
898
+ -
899
+ -
900
+ -
901
+ -
902
+ Frozen [2]
903
+ 5.5M
904
+ 18.7
905
+ 39.5
906
+ 51.6
907
+ 10.0
908
+ 21.1
909
+ 46.0
910
+ 56.2
911
+ 7.0
912
+ 9.3
913
+ 22.0
914
+ 30.1
915
+ 51.0
916
+ OA-Trans [49]
917
+ 5.5M
918
+ 23.4
919
+ 47.5
920
+ 55.6
921
+ 8.0
922
+ 23.5
923
+ 50.4
924
+ 59.8
925
+ 6.0
926
+ -
927
+ -
928
+ -
929
+ -
930
+ ALPRO [23]
931
+ 5.5M
932
+ 24.1
933
+ 44.7
934
+ 55.4
935
+ 8.0
936
+ 23.8
937
+ 47.3
938
+ 57.9
939
+ 6.0
940
+ -
941
+ -
942
+ -
943
+ -
944
+ BridgeFormer [13]
945
+ 5.5M
946
+ 26.0
947
+ 46.4
948
+ 56.4
949
+ 7.0
950
+ 25.6
951
+ 50.6
952
+ 61.1
953
+ 5.0
954
+ 12.2
955
+ 25.9
956
+ 32.2
957
+ 42.0
958
+ MILES [14]
959
+ 5.5M
960
+ 26.1
961
+ 47.2
962
+ 56.9
963
+ 7.0
964
+ 27.2
965
+ 50.3
966
+ 63.6
967
+ 5.0
968
+ 11.1
969
+ 24.7
970
+ 30.6
971
+ 50.7
972
+ TW-BERT
973
+ 5.5M
974
+ 26.4
975
+ 50.1
976
+ 59.6
977
+ 5.0
978
+ 28.4
979
+ 52.9
980
+ 64.5
981
+ 4.0
982
+ 14.2
983
+ 30.4
984
+ 36.0
985
+ 28.0
986
+ HERO [25]
987
+ 120M
988
+ 16.8
989
+ 43.4
990
+ 57.7
991
+ -
992
+ 2.1
993
+ 11.4
994
+ 36.1
995
+ -
996
+ -
997
+ -
998
+ -
999
+ -
1000
+ TACo [57]
1001
+ 120M
1002
+ 28.4
1003
+ 57.8
1004
+ 71.2
1005
+ 4.0
1006
+ -
1007
+ -
1008
+ -
1009
+ -
1010
+ -
1011
+ -
1012
+ -
1013
+ -
1014
+ SupportSet [37]
1015
+ 120M
1016
+ 30.1
1017
+ 58.5
1018
+ 69.3
1019
+ 3.0
1020
+ -
1021
+ -
1022
+ -
1023
+ -
1024
+ -
1025
+ -
1026
+ -
1027
+ -
1028
+ VideoCLIP [54]
1029
+ 110M
1030
+ 30.9
1031
+ 55.4
1032
+ 66.8
1033
+ -
1034
+ -
1035
+ -
1036
+ -
1037
+ -
1038
+ -
1039
+ -
1040
+ -
1041
+ -
1042
+ VIOLET [11]
1043
+ 186M
1044
+ 34.5
1045
+ 63.0
1046
+ 73.4
1047
+ -
1048
+ 32.6
1049
+ 62.8
1050
+ 74.7
1051
+ -
1052
+ 16.1
1053
+ 36.6
1054
+ 41.2
1055
+ -
1056
+ Clipbert [22]
1057
+ 5.6M
1058
+ 22.0
1059
+ 46.8
1060
+ 59.9
1061
+ 6.0
1062
+ 20.4
1063
+ 48.0
1064
+ 60.8
1065
+ 6.0
1066
+ -
1067
+ -
1068
+ -
1069
+ -
1070
+ Frozen [2]
1071
+ 5.5M
1072
+ 31.0
1073
+ 59.5
1074
+ 70.5
1075
+ 3.0
1076
+ 31.0
1077
+ 59.8
1078
+ 72.4
1079
+ 3.0
1080
+ 15.0
1081
+ 30.8
1082
+ 39.8
1083
+ 20.0
1084
+ ALPRO [23]
1085
+ 5.5M
1086
+ 33.9
1087
+ 60.7
1088
+ 73.2
1089
+ 3.0
1090
+ 35.9
1091
+ 67.5
1092
+ 78.8
1093
+ 3.0
1094
+ -
1095
+ -
1096
+ -
1097
+ -
1098
+ OA-Trans [49]
1099
+ 5.5M
1100
+ 35.8
1101
+ 63.4
1102
+ 76.5
1103
+ 3.0
1104
+ 34.8
1105
+ 64.4
1106
+ 75.1
1107
+ 3.0
1108
+ 18.2
1109
+ 34.3
1110
+ 43.7
1111
+ 18.5
1112
+ BridgeFormer [13]
1113
+ 5.5M
1114
+ 37.6
1115
+ 64.8
1116
+ 75.1
1117
+ 3.0
1118
+ 37.0
1119
+ 62.2
1120
+ 73.9
1121
+ 3.0
1122
+ 17.9
1123
+ 35.4
1124
+ 44.5
1125
+ 15.0
1126
+ MILES [14]
1127
+ 5.5M
1128
+ 37.7
1129
+ 63.6
1130
+ 73.8
1131
+ 3.0
1132
+ 36.6
1133
+ 63.9
1134
+ 74.0
1135
+ 3.0
1136
+ 17.8
1137
+ 35.6
1138
+ 44.1
1139
+ 15.5
1140
+ TW-BERT
1141
+ 5.5M
1142
+ 38.4
1143
+ 65.1
1144
+ 76.6
1145
+ 3.0
1146
+ 41.8
1147
+ 71.1
1148
+ 81.2
1149
+ 2.0
1150
+ 21.0
1151
+ 38.8
1152
+ 49.2
1153
+ 11.0
1154
+ Table 3. ActivityNet Caption with fine-tuning setting.
1155
+ Method
1156
+ #PT Pairs
1157
+ R@1↑
1158
+ R@5↑
1159
+ R@10↑
1160
+ MedR↓
1161
+ Dense [18]
1162
+ -
1163
+ 14.0
1164
+ 32.0
1165
+ -
1166
+ 34.0
1167
+ FSE [60]
1168
+ -
1169
+ 18.2
1170
+ 44.8
1171
+ -
1172
+ 7.0
1173
+ CE [28]
1174
+ -
1175
+ 18.2
1176
+ 47.7
1177
+ -
1178
+ 6.0
1179
+ HSE [60]
1180
+ -
1181
+ 20.5
1182
+ 49.3
1183
+ -
1184
+ -
1185
+ Clipbert [22]
1186
+ 5.6M
1187
+ 21.3
1188
+ 49.0
1189
+ 63.5
1190
+ 6.0
1191
+ TW-BERT
1192
+ 5.5M
1193
+ 31.7
1194
+ 62.3
1195
+ 74.9
1196
+ 3.0
1197
+ Table 4. Experiments of video question answering on MSRVTT
1198
+ and MSVD datasets in top-1 accuracy (%).
1199
+ Method
1200
+ #PT Pairs
1201
+ MSRVTT
1202
+ MSVD
1203
+ Clipbert [22]
1204
+ 5.6M
1205
+ 37.4
1206
+ -
1207
+ ALPRO [23]
1208
+ 5.5M
1209
+ 42.1
1210
+ 45.9
1211
+ SINGULARITY [21]
1212
+ 5.5M
1213
+ 42.7
1214
+ 45.9
1215
+ LGDN [30]
1216
+ 15.2M
1217
+ 43.1
1218
+ -
1219
+ SSML [1]
1220
+ 100M
1221
+ 35.1
1222
+ 35.1
1223
+ JustAsk [56]
1224
+ 69M
1225
+ 41.5
1226
+ 46.3
1227
+ MERLOT [59]
1228
+ 180M
1229
+ 43.1
1230
+ -
1231
+ VIOLET [11]
1232
+ 186M
1233
+ 43.9
1234
+ 47.9
1235
+ TW-BERT
1236
+ 5.5M
1237
+ 43.6
1238
+ 48.5
1239
+ TW-BERT, while such marginal improvements are got at
1240
+ the cost of much more training resources.
1241
+ Furthermore,
1242
+ TW-BERT still outperforms VIOLET on the other tasks,
1243
+ e.g., on DiDeMo VDTR, TW-BERT outperforms VIOLET
1244
+ by 9.2% on R@1 or on MSVD VDQA, TW-BERT outper-
1245
+ forms VIOLET by 0.6%. These comparisons confirm the
1246
+ effectiveness of the proposed TW-BERT.
1247
+ 5. Conclusion and Limitation
1248
+ We propose a novel Trajectory-Word BERT (TW-
1249
+ BERT) that builds Trajectory-to-Word alignments for solv-
1250
+ ing video-language tasks. In particular, we introduce an
1251
+ asymmetric cross-modal encoder which contains word-to-
1252
+ patch (W2P) and Trajectory-to-Word (T2W) to capture
1253
+ cross-modal associations. Moreover, the fine-grained con-
1254
+ trastive loss is proposed to amplify the local details for help-
1255
+ ing the subsequent cross-modal encoder build more robust
1256
+ connections.
1257
+ Extensive experiments across diverse tasks
1258
+ confirm the effectiveness of the proposed TW-BERT.
1259
+ There are two limitations which may limit the model’s
1260
+ effectiveness.
1261
+ Firstly, as Table 2 shows, various VDL-
1262
+ BERTs train their model by 120M video-text pairs while
1263
+ we only use 5.5M. Secondly, we do not consider the tra-
1264
+ jectory characteristic in the video encoder while only in
1265
+ the cross-modal, which may miss certain temporal contexts.
1266
+ We do this since the words contain integral semantic knowl-
1267
+ edge that can help efficiently locate the trajectory, while if
1268
+ we consider the trajectory characteristic in the video en-
1269
+ coder, each pixel/patch should be tracked across the whole
1270
+ video, which has higher computation complexity. To solve
1271
+ two limitations, the ideas of efficient Transformers [36,38]
1272
+ can be brought in our TW-BERT to reduce the computation
1273
+ 8
1274
+
1275
+ complexity and we will also extend our computation power
1276
+ like the GPU servers to train a trajectory-based video en-
1277
+ coder.
1278
+ References
1279
+ [1] Elad Amrani, Rami Ben-Ari, Daniel Rotman, and Alex
1280
+ Bronstein.
1281
+ Noise estimation using density estimation for
1282
+ self-supervised multimodal learning. In AAAI, pages 6644–
1283
+ 6652, 2021. 8
1284
+ [2] Max Bain, Arsha Nagrani, G¨ul Varol, and Andrew Zisser-
1285
+ man. Frozen in time: A joint video and image encoder for
1286
+ end-to-end retrieval. In Proceedings of the IEEE/CVF Inter-
1287
+ national Conference on Computer Vision, page 1728–1738,
1288
+ 2021. 1, 2, 3, 5, 8
1289
+ [3] Hangbo Bao, Li Dong, and Furu Wei. Beit: Bert pre-training
1290
+ of image transformers.
1291
+ arXiv preprint arXiv:2106.08254,
1292
+ 2021. 1
1293
+ [4] Gedas Bertasius, Heng Wang, and Lorenzo Torresani.
1294
+ Is
1295
+ space-time attention all you need for video understanding.
1296
+ arXiv preprint arXiv:2102.05095, 2021. 2, 3
1297
+ [5] David Chen and William B Dolan. Collecting highly parallel
1298
+ data for paraphrase evaluation. meeting of the association for
1299
+ computational linguistics, 2011. 6
1300
+ [6] Xinlei Chen, Hao Fang, Tsung-Yi Lin, Ramakrishna Vedan-
1301
+ tam, Saurabh Gupta, Piotr Dollar, , and C. Lawrence Zit-
1302
+ nick. Microsoft coco captions: Data collection and evalua-
1303
+ tion server. arXiv preprint arXiv:1504.00325, 2015. 2
1304
+ [7] Yen-Chun Chen, Linjie Li, Licheng Yu, Ahmed El Kholy,
1305
+ Faisal Ahmed, Zhe Gan, Yu Cheng, and Jingjing Liu. Uniter:
1306
+ Universal image-text representation learning.
1307
+ In ECCV,
1308
+ 2020. 1, 2
1309
+ [8] Jacob Devlin, Ming-Wei Chang, Kenton Lee, and Kristina
1310
+ Toutanova.
1311
+ Bert:
1312
+ Pre-training of deep bidirectional
1313
+ transformers for language understanding.
1314
+ arXiv preprint
1315
+ arXiv:1810.04805, 2018. 6
1316
+ [9] Xiaoyi Dong, Jianmin Bao, Ting Zhang, Dongdong Chen,
1317
+ Weiming Zhang, Lu Yuan, Fang Wen, and Nenghai Yu. Peco:
1318
+ Perceptual codebook for bert pre-training of vision trans-
1319
+ formers. arXiv preprint arXiv:2111.12710, 2021. 1
1320
+ [10] Alexey Dosovitskiy, Lucas Beyer, Alexander Kolesnikov,
1321
+ Dirk Weissenborn, Xiaohua Zhai, Thomas Unterthiner,
1322
+ Mostafa Dehghani, Matthias Minderer, Georg Heigold, Syl-
1323
+ vain Gelly, Jakob Uszkoreit, and Neil Houlsby. An image is
1324
+ worth 16x16 words: Transformers for image recognition at
1325
+ scale. In ICLR, 2021. 3
1326
+ [11] Tsu-Jui Fu, Linjie Li, Zhe Gan, Kevin Lin, William Yang
1327
+ Wang, Lijuan Wang, and Zicheng Liu. Violet : End-to-end
1328
+ video-language transformers with masked visual-token mod-
1329
+ eling. arXiv preprint arXiv:2111.12681, 2021. 2, 3, 5, 6, 8
1330
+ [12] Valentin Gabeur, Chen Sun, Karteek Alahari, and Cordelia
1331
+ Schmid.
1332
+ Multi-modal transformer for video retrieval.
1333
+ In
1334
+ ECCV, pages 214–229, 2020. 1
1335
+ [13] Yuying Ge, Yixiao Ge, Xihui Liu, Dian Li, Ying Shan, Xi-
1336
+ aohu Qie, and Ping Luo. Bridgeformer: Bridging video-text
1337
+ retrieval with multiple choice questions.
1338
+ In CVPR, pages
1339
+ 16167–16176, 2022. 3, 5, 6, 8
1340
+ [14] Yuying Ge, Yixiao Ge, Xihui Liu, Alex Jinpeng Wang, Jian-
1341
+ ping Wu, Ying Shan, Xiaohu Qie, and Ping Luo. Miles: Vi-
1342
+ sual bert pre-training with injected language semantics for
1343
+ video-text retrieval. arXiv preprint arXiv:2204.12408, 2022.
1344
+ 5, 6, 8
1345
+ [15] Lisa Anne Hendricks, Oliver Wang, Eli Shechtman, Josef
1346
+ Sivic, Trevor Darrell, and Bryan Russell. Localizing mo-
1347
+ ments in video with natural language.
1348
+ In ICCV, page
1349
+ 5804–5813, 2017. 5, 6, 7
1350
+ [16] Chao Jia, Yinfei Yang, Ye Xia, Yi-Ting Chen, Zarana Parekh,
1351
+ Hieu Pham, Quoc V. Le, Yun-Hsuan Sung, Zhen Li, and Tom
1352
+ Duerig. Scaling up visual and vision-language representation
1353
+ learning with noisy text supervision. In ICML, pages 4904–
1354
+ 4916, 2021. 1
1355
+ [17] Diederik P Kingma and Jimmy Ba. Adam: A method for
1356
+ stochastic optimization.
1357
+ arXiv preprint arXiv:1412.6980,
1358
+ 2014. 6
1359
+ [18] Ranjay Krishna, Kenji Hata, Frederic Ren, Li Fei-Fei, and
1360
+ Juan Carlos Niebles. Dense-captioning events in videos. In
1361
+ ICCV, page 706–715, 2017. 6, 8
1362
+ [19] Ranjay Krishna, Yuke Zhu, Oliver Groth, Justin Johnson,
1363
+ Kenji Hata, Joshua Kravitz, Stephanie Chen, Yannis Kalan-
1364
+ tidis, Li-Jia Li, and David A Shamma. Visual genome: Con-
1365
+ necting language and vision using crowdsourced dense im-
1366
+ age annotations. International Journal of Computer Vision,
1367
+ 2017. 2
1368
+ [20] Zhenzhong Lan, Mingda Chen, Sebastian Goodman, Kevin
1369
+ Gimpel, Piyush Sharma, and Radu Soricut. Albert: A lite
1370
+ bert for self-supervised learning of language representations.
1371
+ arXiv preprint arXiv:1909.11942, 2019. 1
1372
+ [21] Jie Lei, Tamara L. Berg, and Mohit Bansal. Revealing single
1373
+ frame bias for video-and-language learning. arXiv preprint
1374
+ arXiv:2206.03428, 2022. 8
1375
+ [22] Jie Lei, Linjie Li, Luowei Zhou, Zhe Gan, Tamara L. Berg,
1376
+ Mohit Bansal, and Jingjing Liu. Less is more: Clipbert for
1377
+ video-and-language learning via sparse sampling. In CVPR,
1378
+ page 7331–7341, 2021. 2, 3, 6, 8
1379
+ [23] Dongxu Li, Junnan Li, Hongdong Li, Juan Carlos Niebles,
1380
+ and Steven C.H. Hoi.
1381
+ Align and prompt:
1382
+ Video-and-
1383
+ language pre-training with entity prompts. In CVPR, page
1384
+ 4953–4963, 2022. 2, 3, 4, 5, 6, 8
1385
+ [24] Junnan Li, Ramprasaath R. Selvaraju, Akhilesh Gotmare,
1386
+ Shafiq Joty, Caiming Xiong, and Steven C. H. Hoi. Align be-
1387
+ fore fuse: Vision and language representation learning with
1388
+ momentum distillation. In Advances in neural information
1389
+ processing systems, volume 34, pages 9694–9705, 2021. 1,
1390
+ 2, 3, 4, 5, 6
1391
+ [25] Linjie Li, Yen-Chun Chen, Yu Cheng, Zhe Gan, Licheng Yu,
1392
+ and Jingjing Liu. Hero: Hierarchical spatio-temporal reason-
1393
+ ing with contrastive action correspondence for end-to-end
1394
+ video object grounding. arXiv preprint arXiv:2005.00200,
1395
+ 2020. 1, 5, 8
1396
+ [26] Xiujun Li, Xi Yin, Chunyuan Li, Pengchuan Zhang, Xiaowei
1397
+ Hu, Lei Zhang, Lijuan Wang, Houdong Hu, Li Dong, Furu
1398
+ Wei, Yejin Choi, and Jianfeng Gao. Oscar: Object-semantics
1399
+ aligned pre-training for vision-language tasks.
1400
+ In ECCV,
1401
+ 2020. 1, 2
1402
+ 9
1403
+
1404
+ [27] Yanghao Li, Chao-Yuan Wu, Haoqi Fan, Karttikeya Man-
1405
+ galam, Bo Xiong, Jitendra Malik, and Christoph Feichten-
1406
+ hofer. Mvitv2: Improved multiscale vision transformers for
1407
+ classification and detection. In Proceedings of the IEEE/CVF
1408
+ Conference on Computer Vision and Pattern Recognition,
1409
+ pages 4804–4814, 2022. 3
1410
+ [28] Yang Liu, Samuel Albanie, Arsha Nagrani, and Andrew
1411
+ Zisserman.
1412
+ Use what you have:
1413
+ Video retrieval using
1414
+ representations from collaborative experts.
1415
+ arXiv preprint
1416
+ arXiv:1907.13487, 2019. 8
1417
+ [29] Ze Liu, Yutong Lin, Yue Cao, Han Hu, Yixuan Wei, Zheng
1418
+ Zhang, Stephen Lin, and Baining Guo. Swin transformer:
1419
+ Hierarchical vision transformer using shifted windows. In
1420
+ ICCV, pages 10012–10022, 2021. 2, 3
1421
+ [30] Haoyu Lu, Mingyu Ding, Nanyi Fei, Yuqi Huo, and Zhiwu
1422
+ Lu. Lgdn: Language-guided denoising network for video-
1423
+ language modeling. arXiv preprint arXiv:2209.11388, 2022.
1424
+ 8
1425
+ [31] Jiasen Lu, Dhruv Batra, Devi Parikh, and Stefan Lee. Vil-
1426
+ bert: Pretraining task-agnostic visiolinguistic representations
1427
+ for vision-and-language tasks. In Advances in neural infor-
1428
+ mation processing systems, 2019. 2, 3
1429
+ [32] Huaishao Luo, Lei Ji, Botian Shi, Haoyang Huang, Nan
1430
+ Duan, Tianrui Li, Xilin Chen, and Ming Zhou.
1431
+ Uni-
1432
+ vilm: A unified video and language pre-training model for
1433
+ multimodal understanding and generation.
1434
+ arXiv preprint
1435
+ arXiv:2002.06353, 2020. 1
1436
+ [33] Huaishao Luo, Lei Ji, Ming Zhong, Yang Chen, Wen Lei,
1437
+ Nan Duan, and Tianrui Li. Clip4clip: An empirical study
1438
+ of clip for end-to-end video clip retrieval.
1439
+ arXiv preprint
1440
+ arXiv:2104.08860, 2021. 1, 5
1441
+ [34] Antoine Miech, Jean-Baptiste Alayrac, Lucas Smaira, Ivan
1442
+ Laptev, Josef Sivic, and Andrew Zisserman.
1443
+ End-to-end
1444
+ learning of visual representations from uncurated instruc-
1445
+ tional videos. In CVPR, pages 9879–9889, 2020. 1
1446
+ [35] Antoine Miech, Jean-Baptiste Alayrac, Lucas Smaira, Ivan
1447
+ Laptev, Josef Sivic, and Andrew Zisserman.
1448
+ End-to-end
1449
+ learning of visual representations from uncurated instruc-
1450
+ tional videos. In CVPR, page 9879–9889, 2020. 5, 8
1451
+ [36] Mandela Patrick, Dylan Campbell, Yuki M. Asano, Is-
1452
+ han Misra, Florian Metze, Christoph Feichtenhofer, Andrea
1453
+ Vedaldi, and Jo˜ao F. Henriques. Keeping your eye on the
1454
+ ball: Trajectory attention in video transformers. In Advances
1455
+ in neural information processing systems, volume 34, pages
1456
+ 12493–12506, 2021. 8
1457
+ [37] Mandela Patrick, Po-Yao Huang, Yuki Asano, Florian
1458
+ Metze, Alexander G Hauptmann, Joao F Henriques, and An-
1459
+ drea Vedaldi. Support-set bottlenecks for video-text repre-
1460
+ sentation learnings. In ICLR, 2020. 8
1461
+ [38] Zhaofan Qiu, Ting Yao, Chong-Wah Ngo, Xinmei Tian, and
1462
+ Tao Mei. Learning spatio-temporal representation with local
1463
+ and global diffusion. In CVPR, pages 12056–12065, 2019. 8
1464
+ [39] Alec Radford, Jong Wook Kim, Chris Hallacy, Aditya
1465
+ Ramesh, Gabriel Goh, Sandhini Agarwal, Girish Sastry,
1466
+ Amanda Askell, Pamela Mishkin, and Jack Clark. Learn-
1467
+ ing transferable visual models from natural language super-
1468
+ visions. In ICML, pages 8748–8763, 2021. 5
1469
+ [40] Aditya Ramesh,
1470
+ Mikhail Pavlov,
1471
+ Gabriel Goh,
1472
+ Scott
1473
+ Gray, Chelsea Voss, Alec Radford, Mark Chen, and Ilya
1474
+ Sutskever.
1475
+ Zero-shot text-to-image generation.
1476
+ arXiv
1477
+ preprint arXiv:2102.12092, 2021. 7
1478
+ [41] Shaoqing Ren, Kaiming He, Ross Girshick, and Jian Sun.
1479
+ Faster r-cnn: Towards real-time object detection with region
1480
+ proposal networks. IEEE Transactions on Pattern Analysis
1481
+ and Machine Intelligence, 2015. 2
1482
+ [42] Tal Ridnik, Emanuel Ben-Baruch, Asaf Noy, and Lihi Zel-
1483
+ nikManor. Imagenet-21k pretraining for the masses. arXiv
1484
+ preprint arXiv:2104.10972, 2021. 6
1485
+ [43] Anna Rohrbach, Marcus Rohrbach, Niket Tandon, and Bernt
1486
+ Schiele. A dataset for movie description. In CVPR, page
1487
+ 3202–3212, 2015. 6
1488
+ [44] Victor Sanh,
1489
+ Lysandre Debut,
1490
+ Julien Chaumond,
1491
+ and
1492
+ Thomas Wolf. Distilbert, a distilled version of bert: smaller,
1493
+ faster, cheaper and lighter. arXiv preprint arXiv:1910.01108,
1494
+ 2019. 1
1495
+ [45] Piyush Sharma, Nan Ding, Sebastian Goodman, and Radu
1496
+ Soricut. Conceptual captions: A cleaned, hypernymed, im-
1497
+ age alt-text dataset for automatic image captioning. In ACL,
1498
+ page 2556–2565, 2018. 5
1499
+ [46] Chen Sun, Fabien Baradel, Kevin Murphy, and Cordelia
1500
+ Schmid.
1501
+ Learning video representations using contrastive
1502
+ bidirectional transformer. arXiv preprint arXiv:1906.05743,
1503
+ 2019. 1
1504
+ [47] Chen Sun, Austin Myers, Carl Vondrick, Kevin Murphy, and
1505
+ Cordelia Schmid. Videobert: A joint model for video and
1506
+ language representation learning. In ICCV, page 7464–7473,
1507
+ 2019. 1, 2, 3
1508
+ [48] Hao Tan and Mohit Bansal.
1509
+ Lxmert:
1510
+ Learning cross-
1511
+ modality encoder representations from transformers. arXiv
1512
+ preprint arXiv:1908.07490, 2019. 2
1513
+ [49] Alexander Wang, Yixiao Ge, Guanyu Cai, Rui Yan, Xudong
1514
+ Lin, Ying Shan, Xiaohu Qie, and Mike Zheng Shou. Object-
1515
+ aware video-language pre-training for retrieval. In CVPR,
1516
+ pages 3313–3322, 2022. 5, 6, 8
1517
+ [50] Alex Jinpeng Wang, Yixiao Ge, Rui Yan, Yuying Ge,
1518
+ Xudong Lin, Guanyu Cai, Jianping Wu, Ying Shan, Xi-
1519
+ aohu Qie, and Mike Zheng Shou.
1520
+ All in one: Explor-
1521
+ ing unified video-language pre-training.
1522
+ arXiv preprint
1523
+ arXiv:2203.07303, 2022. 5
1524
+ [51] Yau-Shian Wang, Hung yi Lee, and Yun-Nung Chen. Tree
1525
+ transformer: Integrating tree structures into self-attention.
1526
+ arXiv preprint arXiv:1909.06639, 2019. 1
1527
+ [52] Dejing Xu, Zhou Zhao, Jun Xiao, Fei Wu, Hanwang Zhang,
1528
+ Xiangnan He, and Yueting Zhuang. Video question answer-
1529
+ ing via gradually refined attention over appearance and mo-
1530
+ tion. In ACM International Conference on Multimedia, pages
1531
+ 1645–1653, 2017. 6
1532
+ [53] Hu Xu,
1533
+ Gargi Ghosh,
1534
+ Po-Yao Huang,
1535
+ Prahal Arora,
1536
+ Masoumeh Aminzadeh, Christoph Feichtenhofer, Florian
1537
+ Metze, and Luke Zettlemoyer. Vlm: Task-agnostic video-
1538
+ language model pre-training for video understanding. arXiv
1539
+ preprint arXiv:2105.09996, 2021. 1
1540
+ [54] Hu Xu, Gargi Ghosh, Po-Yao Huang, Dmytro Okhonko,
1541
+ Armen Aghajanyan, Florian Metze, Luke Zettlemoyer, and
1542
+ 10
1543
+
1544
+ Christoph Feichtenhofer. Videoclip: Contrastive pre-training
1545
+ for zero-shot video-text understanding.
1546
+ arXiv preprint
1547
+ arXiv:2109.14084, 2021. 5, 8
1548
+ [55] Jun Xu, Tao Mei, Ting Yao, and Yong Rui. Msrvtt: A large
1549
+ video description dataset for bridging video and language. In
1550
+ CVPR, pages 5288–5296, 2016. 5, 6, 7
1551
+ [56] Antoine Yang, Antoine Miech, Josef Sivic, Ivan Laptev, and
1552
+ Cordelia Schmid. Just ask: Learning to answer questions
1553
+ from millions of narrated videos.
1554
+ In ICCV, pages 1686–
1555
+ 1697, 2021. 8
1556
+ [57] Jianwei Yang, Yonatan Bisk, and Jianfeng Gao.
1557
+ Taco:
1558
+ Token-aware cascade contrastive learning for video-text
1559
+ alignment. In ICCV, page 11562–11572, 2021. 8
1560
+ [58] Lewei Yao, Runhui Huang, Lu Hou, Guansong Lu, Minzhe
1561
+ Niu, Hang Xu, Xiaodan Liang, Zhenguo Li, Xin Jiang, and
1562
+ Chunjing Xu. Filip: Fine-grained interactive language-image
1563
+ pre-training. arXiv preprint arXiv:2111.07783, 2021. 3
1564
+ [59] Rowan Zellers, Ximing Lu, Jack Hessel, Youngjae Yu,
1565
+ Jae Sung Park, Jize Cao, Ali Farhadi, and Yejin Choi. Merlot:
1566
+ Multimodal neural script knowledge models. In Advances
1567
+ in neural information processing systems, volume 34, page
1568
+ 23634–23651, 2021. 7, 8
1569
+ [60] Bowen Zhang, Hexiang Hu, and Fei Sha. Cross-modal and
1570
+ hierarchical modeling of video and text. In ECCV, pages
1571
+ 374–390, 2018. 8
1572
+ [61] Jinghao Zhou, Chen Wei, Huiyu Wang, Wei Shen, Ci-
1573
+ hang Xie, Alan L. Yuille, and Tao Kong.
1574
+ ibot:
1575
+ Im-
1576
+ age bert pre-training with online tokenizer. arXiv preprint
1577
+ arXiv:2111.07832, 2021. 1
1578
+ [62] Linchao Zhu and Yi Yang. Actbert: Learning global-local
1579
+ video-text representations. In CVPR, page 8746–8755, 2020.
1580
+ 2, 8
1581
+ 11
1582
+
ANAzT4oBgHgl3EQf_v-e/content/tmp_files/load_file.txt ADDED
The diff for this file is too large to render. See raw diff
 
ANE4T4oBgHgl3EQfEgyT/content/2301.04878v1.pdf ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:e68ece04b63bf450e57b827938aa7ac872dc5fc0772526e8a9f868a3cae62b88
3
+ size 3302883
ANE4T4oBgHgl3EQfEgyT/vector_store/index.faiss ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:9f717539c96673fc47dc21f557b1950ab8aa1f6e035fa2bbef6455b3beeb3449
3
+ size 2162733
ANE4T4oBgHgl3EQfEgyT/vector_store/index.pkl ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:3a6d3c9a0fb15c66d155e50ad2097dbcc7525c65cd780b0708f9c3b146eeea35
3
+ size 79924
C9FQT4oBgHgl3EQf_jdA/vector_store/index.faiss ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:8ea853c4c98493a787e35ca481664be02b131aa158d02be77042a6e8f44258b1
3
+ size 3932205
CtE4T4oBgHgl3EQfeg0W/content/2301.05099v1.pdf ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:f5a14e703f5114783e0e5756f72e5f27c3027f0f9432d6c175505980c669cc86
3
+ size 915359
CtE4T4oBgHgl3EQfeg0W/vector_store/index.pkl ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:00c007e6e46b6e89bc84bd22f6e374e858e4bbad8322dfc9bf6b71cbf5bd11af
3
+ size 111070
ENE2T4oBgHgl3EQf9wlw/content/tmp_files/2301.04231v1.pdf.txt ADDED
@@ -0,0 +1,845 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Intrinsic interface adsorption drives selectivity in atomically smooth nanofluidic channels
2
+ Phillip Helms,1, 2 Anthony R. Poggioli,1, 3 and David T. Limmer1, 2, 4, 3, ∗
3
+ 1Department of Chemistry, University of California, Berkeley, California 94720, USA
4
+ 2Chemical Science Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA
5
+ 3Kavli Energy NanoScience Institute, Berkeley, California 94720, USA
6
+ 4Materials Science Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA
7
+ (Dated: January 12, 2023)
8
+ Specific molecular interactions underlie unexpected and useful phenomena in nanofluidic systems, but re-
9
+ quire descriptions that go beyond traditional macroscopic hydrodynamics. In this letter, we demonstrate how
10
+ equilibrium molecular dynamics simulations and linear response theory can be synthesized with hydrodynam-
11
+ ics to provide a comprehensive characterization of nanofluidic transport. Specifically, we study the pressure
12
+ driven flows of ionic solutions in nanochannels comprised of two-dimensional crystalline substrates made from
13
+ graphite and hexagonal boron nitride. While simple hydrodynamic descriptions do not predict a streaming elec-
14
+ trical current or salt selectivity in such simple systems, we observe that both arise due to the intrinsic molecular
15
+ interactions that act to selectively adsorb ions to the interface in the absence of a net surface charge. Notably,
16
+ this emergent selectivity indicates that these nanochannels can serve as desalination membranes.
17
+ Recent advances in nanoscale fabrication techniques have
18
+ enabled the synthesis of nanofluidic systems with novel
19
+ functionalities, [1–3] with applications to biotechnology [4],
20
+ filtration [5–7], and computation [8–10].
21
+ For example,
22
+ nanofluidics-based membranes have leveraged atomic level
23
+ details like those of evolved biological membranes [11–18]
24
+ to circumvent traditional trade-offs between permeability and
25
+ selectivity that plague membrane technology [19–22]. While
26
+ continuum-level hydrodynamic descriptions can remain accu-
27
+ rate at scales of a few nanonmeters, enabling some general de-
28
+ sign principles to be deduced [23–26], the continued develop-
29
+ ment of nanofluidic devices is limited by a lack of understand-
30
+ ing of emergent interfacial effects which are resolutely molec-
31
+ ular in origin. With large surface to volume ratios, the prop-
32
+ erties of fluids confined to nanometer scales are determined in
33
+ large part by a delicate interplay of interactions between the
34
+ bounding surfaces and the working fluid. To understand and
35
+ design nanofluidic devices, an approach that combines macro-
36
+ scopic and molecular perspectives is necessary [27].
37
+ In this letter, we show how interfacial atomic structure
38
+ affects the directed transport of an electrolyte solution in
39
+ nanochannels made of atomically flat graphite (GR) and
40
+ hexagonal boron nitride (BN) walls using molecular dynamics
41
+ simulations unified with a contemporary perspective on hydro-
42
+ dynamics. These simple nanofluidic systems have been stud-
43
+ ied extensively because of their intriguing transport properties,
44
+ such as anomalously high permeabilities in GR [28–36], and
45
+ the potential to augment their functionality with selectivity for
46
+ desalination or blue energy applications [37–46]. By com-
47
+ puting the spatially-resolved volumetric, charge, and species
48
+ transport coefficients from equilibrium correlations [47–49]
49
+ we elucidate the importance of specific molecular interactions
50
+ on nanofluidic device functionality.
51
+ While from a contin-
52
+ uum perspective, driving the solution with a pressure gradient
53
+ should result in salt filtration or electric current only when the
54
+ confining walls have a net charge, we discover that the intrinsic
55
+ interfacial adsorption of ions can lead to streaming electrical
56
+ currents and a novel, emergent desalination mechanism.
57
+ We focus on the two systems illustrated in Fig. 1(a), consist-
58
+ ing of an aqueous solution of potassium chloride confined in
59
+ nanochannels with fixed walls of either BN or GR. Because of
60
+ the experimental similarity between the structure of BN and
61
+ GR lattices, we spaced atoms and lattice layers identically,
62
+ with interatomic and interlayer spacings of 1.42 Å and 3.38
63
+ Å [50, 51]. Each wall has three layers, using AA’ and AB
64
+ stacking for BN and GR, respectively, to match their equilib-
65
+ rium structures, with lattice unit cells repeated 8 and 13 times
66
+ in the 푥 and 푦 directions for a cross-sectional surface area of
67
+ nearly 9 nm2. The walls were separated such that the spacing
68
+ between the center of mass of the innermost wall layers was
69
+ 퐻 ≈ 5.7 nm, with the channel width adjusted to ensure a bulk
70
+ water density of ̄휌w ≈ 1 g∕cm3. The channels were filled with
71
+ 푁w = 1920 TIP4P/2005 water molecules with rigid geome-
72
+ tries imposed using the SHAKE algorithm [52, 53], 푁K+ = 40
73
+ potassium ions and 푁Cl− = 40 chloride ions, resulting in a
74
+ nearly 1 M electrolyte solution.
75
+ We
76
+ evolved
77
+ this
78
+ system
79
+ according
80
+ to
81
+ underdamped
82
+ Langevin dynamics,
83
+ 푚푖 ̇퐯푖 = −휁푖퐯푖 + 퐅푖
84
+ (퐫푁) + 퐑푖
85
+ (1)
86
+ where each particle 푖 has mass 푚푖, velocity 퐯푖, and experi-
87
+ ences a friction 휁푖, with forcing from interparticle interac-
88
+ tions 퐅푖
89
+ (퐫푁), and random noise 퐑푖. The random force is a
90
+ Gaussian random variable with mean ⟨푅푖,훼⟩ = 0 and variance
91
+ ⟨푅푖,훼(푡)푅푖′,훼′(푡′)⟩ = 2푘B푇 휁푖훿푖,푖′훿훼,훼′훿(푡−푡′) for each cartesian
92
+ coordinate 훼, where 푘B푇 is Boltzmann’s constant times tem-
93
+ perature. Periodic boundary conditions were imposed in all
94
+ three spatial dimensions, with a vacuum layer in the 푧 direction
95
+ of 5 nm to ensure no interaction between periodic images of
96
+ the channel. Intermolecular Lennard-Jones forces were chosen
97
+ from literature-reported values to reproduce the solubility of
98
+ ions in water and match the ab initio equilibrium fluid structure
99
+ in BN and GR nanochannels [54, 55], with Lorentz-Berthelot
100
+ mixing rules defining heteroatomic interactions.
101
+ Addition-
102
+ ally, water molecules, charged ions, and the BN wall atoms
103
+ interacted with Coulomb potentials, where boron and nitro-
104
+ arXiv:2301.04231v1 [cond-mat.mes-hall] 10 Jan 2023
105
+
106
+ 2
107
+ FIG. 1. Description of the systems considered and resulting equilib-
108
+ rium density distributions. (a) A snapshot of the nanochannels con-
109
+ sidered with the left (right) side corresponding to the boron nitride
110
+ (graphite) nanochannel. The top images show the wall structure, with
111
+ each wall composed of three layers and the periodic unit cell outlined
112
+ in red. (b) The molecular species density distributions for potassium
113
+ (green), chloride (purple), and water (black) as a function of position,
114
+ normalized by bulk densities.
115
+ gen atoms have charges of ± 1.05e, with e being the elemen-
116
+ tary charge, using an Ewald summation as implemented in
117
+ LAMMPS [56]. For all data presented here, we performed
118
+ 5 independent simulations, each starting with an equilibration
119
+ run for 5 ns with 푚푖∕휉푖 = 2 ps, followed by a production run for
120
+ 10−20 ns with 푚푖∕휉푖 = 10 ns at a temperature of 298 K. In all
121
+ plots, lines represent averages and error bars represent the stan-
122
+ dard deviation for the 5 simulations. All scripts used to pro-
123
+ duce these results and the raw data are openly available [57].
124
+ Figure 1(b) shows the equilibrium particle number densi-
125
+ ties, 휌푖(푧), for all species, 푖 = {w, K+, Cl−}, in the BN and
126
+ GR channels, relative to their bulk values, ̄휌푖. We observe
127
+ similar structures in both materials with interfacial layering
128
+ of water that is consistent with previous simulations of neat
129
+ water[35, 55]. The distribution of ions near such interfaces
130
+ is known to be highly dependent on ion species, and the pro-
131
+ files shown are consistent with previous simulations [58–60]
132
+ A dense layer of pure water accumulates near the wall, with the
133
+ molecules oriented such that they induce a small local negative
134
+ charge. The next layers are enriched in alternating concentra-
135
+ tions of potassium and chloride ions, with depletion (accumu-
136
+ lation) of water molecules accompanying potassium (chloride)
137
+ enrichment. The two materials differ slightly, with a higher
138
+ water density in the first layer of BN resulting in layering with
139
+ higher amplitude in BN compared to GR, though in both sys-
140
+ tems the layering in the density decays to its bulk value for
141
+ each species, ̄휌푖, within 1.5 nm.
142
+ We consider fluxes induced by a pressure differential,
143
+ −Δ푃푥, imposed electrostatic potential drop −ΔΦ푥, or water
144
+ chemical potential differential, −Δ휇푥, with subscripts denot-
145
+ ing application in the 푥 direction parallel to the walls, and limit
146
+ ourselves to small driving strengths. In this limit, linear re-
147
+ sponse theory dictates that induced local fluxes are linearly
148
+ dependent on driving forces,
149
+
150
+
151
+ ⎜⎝
152
+ 푞(푧)
153
+ 푗(푧)
154
+ 푑(푧)
155
+
156
+
157
+ ⎟⎠
158
+ =
159
+
160
+
161
+ ⎜⎝
162
+ 푞푄 푞퐽
163
+ 푞퐷
164
+ 푗푄 푗퐽
165
+ 푗퐷
166
+ 푑푄 푑퐽 푑퐷
167
+
168
+
169
+ ⎟⎠
170
+
171
+
172
+ ⎜⎝
173
+ −Δ푃푥
174
+ −ΔΦ푥
175
+ −Δ휇푥
176
+
177
+
178
+ ⎟⎠
179
+ ,
180
+ (2)
181
+ where 푞(푧) is the volumetric flow, 푗(푧) the charge flux, 푑(푧)
182
+ the excess water flux, and the 푎퐵(푧) are the spatially de-
183
+ pendent mobilities. The excess water flux 푑(푧) represents the
184
+ local water flux relative to what would be predicted from the
185
+ bulk water density and the local total flux of water and ions,
186
+ and it is considered here because it is particularly relevant for
187
+ desalination. The diagonal elements of the mobility matrix
188
+ link a given forcing directly to its conjugate flux – e.g., 푗퐽
189
+ links the potential drop −ΔΦ푥 directly to the induced charge
190
+ flux 푗(푧) – while the off-diagonal elements are the so-called
191
+ cross-terms linking, for example, an induced charge flux to an
192
+ applied pressure differential. The total fluxes include the to-
193
+ tal volumetric flow 푄, charge flux 퐽, and excess water flux 퐷.
194
+ We index mobilities by the local induced flux 푎 and total flux
195
+ 퐵 directly conjugate to a particular forcing.
196
+ The local fluxes are defined microscopically as
197
+ 푞(푧, 푡) = 퐻
198
+
199
+
200
+
201
+ 푖=1
202
+ 푣푖,푥(푡)훿 [푧 − 푧푖(푡)]
203
+ 푗(푧, 푡) = 1
204
+ 퐴s
205
+
206
+
207
+ 푖=1
208
+ 푐푖푣푖,푥(푡)훿 [푧 − 푧푖(푡)]
209
+ 푑(푧, 푡) = 1
210
+ 퐴s
211
+
212
+
213
+ 푖=1
214
+ 푣푖,푥(푡) (훿푖,w − 푓 b
215
+ w
216
+ ) 훿 [푧 − 푧푖(푡)]
217
+ (3)
218
+ where particle 푖 has velocity 푣푖,푥(푡) and position 푧푖(푡) at time
219
+ 푡, a static charge of 푐푖, and 훿푖,w is a Kroniker delta that re-
220
+ turns 1 if particle 푖 is a water molecule and is 0 otherwise.
221
+ The bulk mole water fraction is defined as 푓 b
222
+ w = 푁b
223
+ w∕푁b,
224
+ where 푁b
225
+ w and 푁b are respectively the average numbers of wa-
226
+ ter molecules and all molecules in the bulk and 퐴s is the sur-
227
+ face area associated with the fluid-wall interface. The spatial
228
+ dependence can be integrated out by defining total fluxes, such
229
+ as 푄 = 1∕퐻 ∫ 퐻
230
+ 0
231
+ 푑푧 푞(푧), with analogous definitions for 퐽 and
232
+ 퐷. Total channel conductivities can be evaluated as 퐴퐵 =
233
+ 1∕퐻 ∫ 퐻
234
+ 0
235
+ 푑푧 푎퐵(푧), resulting in total flux linear response re-
236
+ lations such as 푄 = −푄푄Δ푃푥 −푄퐽ΔΨ푥 −푄퐷Δ휇푥. While
237
+
238
+ a
239
+ Boron Nitride (BN
240
+ Graphite (GR
241
+ b)
242
+ 2
243
+ 2
244
+ 3
245
+ 4
246
+ 5
247
+ nm
248
+ ; (
249
+ nm3
250
+ the integrated conductivities must obey Onsager reciprocal re-
251
+ lations, 퐴퐵 = 퐵퐴, mobilities are under no such constraint.
252
+ It is possible for 푎퐵(푧) ≠ 푏퐴(푧).
253
+ Rather than attempting to calculate mobilities directly via
254
+ nonequilibrium simulations, we use fluctuation-dissipation re-
255
+ lations in order to obtain transport coefficients from equilib-
256
+ rium flux correlations [47–49]. This allows us to avoid run-
257
+ ning separate nonequilibrium simulations for each term in the
258
+ mobility matrix, and ensures the validity of linear response.
259
+ We adopt the Einstein-Helfand approach over the Green-Kubo
260
+ method, as recent work has demonstrated its enhanced sta-
261
+ tistical efficiency [47]. Mobilities are obtained as the long
262
+ time slope of the correlation between time-integrated local and
263
+ global fluxes
264
+ 푎퐵 =
265
+
266
+ 2푘B푇 lim
267
+ 푡→∞
268
+ 휅푎퐵(푡)
269
+
270
+ ,
271
+ (4)
272
+ with the correlation function
273
+ 휅푎퐵 = ∫
274
+
275
+ 0
276
+ 푑푡′
277
+
278
+
279
+ 0
280
+ 푑푡′′ ⟨푎(푧, 푡′) 퐵(푡′′)⟩ ,
281
+ (5)
282
+ volume
283
+
284
+ =
285
+ 퐴s퐻,
286
+ and
287
+ brackets
288
+ representing
289
+ an
290
+ equilibrium
291
+ average.
292
+ Similarly,
293
+ conductivities
294
+ can
295
+ be
296
+ obtained
297
+ using
298
+ correlations
299
+ between
300
+ global
301
+ fluxes,
302
+ 퐴퐵
303
+ =
304
+ (푉 ∕2푘B푇 ) lim푡→∞ 퐾퐴퐵(푡)∕푡
305
+ with
306
+ 퐾퐴퐵 = ∫ 푡
307
+ 0 푑푡′ ∫ 푡
308
+ 0 푑푡′′ ⟨퐴(푡′)퐵(푡′′)⟩.
309
+ Previous work has demonstrated that while equilibrium
310
+ structures suggest only minor differences between water in BN
311
+ and GR nanochannels, the dynamics of the confined fluid are
312
+ strikingly different. This results in large differences in the fric-
313
+ tion between the fluid and walls, and significant differences
314
+ in resultant channel permeabilities.
315
+ [28, 35, 61, 62]. In the
316
+ presence of ions, the interfacial structure of water is altered
317
+ and as a consequence the friction may change. In Fig. 2 (a),
318
+ we show the integrated global flux correlation function 퐾푄푄
319
+ as a function of time for both nanochannels. After approx-
320
+ imately 200 ps, the correlation functions approach a linear
321
+ dependence on time and their slopes give the hydraulic con-
322
+ ductivities as [BN]
323
+ 푄푄
324
+ = 18.0 ± 9.2 mol nm5 kJ−1 ns−1 and
325
+ [GR]
326
+ 푄푄 = 106 ± 40 mol nm5 kJ−1 ns−1, which differ by nearly
327
+ an order of magnitude.
328
+ While the hydraulic conductivities deduced above are inde-
329
+ pendent of a specific hydrodynamic model, they can be con-
330
+ nected to continuum theory through the slip length 푙s. In con-
331
+ trast to the no-slip condition typically applied in macroscopic
332
+ contexts, which specifies that the fluid velocity exactly van-
333
+ ishes at the walls, the small confinement scales and enhanced
334
+ importance of interfacial details in nanofluidic applications
335
+ typically require application of the finite-slip condition. This
336
+ condition specifies that the velocity at the wall is proportional
337
+ to the shear strain at the wall, 푣푥 = 푙s(휕푣푥∕휕푧)|푧=0. The slip
338
+ length is interpreted geometrically as the distance beyond the
339
+ interface where the extrapolated flow profile is zero, as illus-
340
+ trated in Fig. 2 (b).
341
+ FIG. 2. Comparison of the hydraulic conductivity and slip length for
342
+ the GR (black) and BN (blue) nanochannels. (a) The time-integrated
343
+ global flux correlation function 퐾푄푄 versus time. (b) Comparison
344
+ of the slip lengths for both materials, computed from the hydraulic
345
+ conductivity (dark), against previously reported results for neat water
346
+ (light) [28]. The inset illustrates the geometric interpretation of the
347
+ slip length.
348
+ To apply a hydrodynamic interpretation, we consider only
349
+ the region where a hydrodynamic description is expected to be
350
+ valid by defining the effective hydrodynamic interface as the
351
+ the location of the second water density peak in Fig. 1(b) [26].
352
+ At this distance, microscopic density correlations have de-
353
+ cayed and the fluid is well described as a continuous medium.
354
+ The Poiseuille solution for the hydraulic mobility in the pres-
355
+ ence of a finite slip length is given by
356
+ 푞푄(푧) =
357
+ 퐻2
358
+ hyd
359
+ 2휂
360
+ [
361
+ 푙s
362
+ 퐻hyd
363
+ +
364
+
365
+ 퐻hyd
366
+
367
+ 푧2
368
+ 퐻2
369
+ hyd
370
+ ]
371
+ ,
372
+ (6)
373
+ where 퐻hyd is the distance between hydrodynamic interfaces,
374
+ and 휂 is the estimated viscosity of the solution. This expression
375
+ may be integrated to determine the hydraulic conductivity
376
+ 푄푄 =
377
+ 퐻2
378
+ hyd
379
+ 12휂
380
+ (
381
+ 1 + 6
382
+ 푙s
383
+ 퐻hyd
384
+ )
385
+ ,
386
+ (7)
387
+ which allows us to relate the measured values of 푄푄 in GR
388
+ and BN to the corresponding slip lengths provided 휂 is known.
389
+ Here, we use a viscosity of 휂 = 1.0 mPa s, obtained by interpo-
390
+ lating literature values for this electrolyte model [54]. Figure 2
391
+
392
+ a)
393
+ 6
394
+ 2
395
+ nm
396
+ 2
397
+ 0
398
+ 0
399
+ 100
400
+ 200
401
+ 300
402
+ 400
403
+ t/ps
404
+ b)
405
+ 40
406
+ (2) 7
407
+ nm
408
+ 20
409
+ 0
410
+ BN
411
+ GR4
412
+ FIG. 3. Pressure driven hydraulic (a), streaming (b), and excess wa-
413
+ ter (c) mobility profiles for BN (left, blue) and GR (right, black).
414
+ The red shaded regions demarcate areas where hydrodynamics are
415
+ invalidated. In (a), the red dashed curve corresponds to the hydrody-
416
+ namic estimate from the hydraulic conductivity. In (b) and (c), the
417
+ red dashed curves are the mobility predictions from the product of
418
+ the hydraulic mobility and appropriate density.
419
+ (b) indicates the resulting slip lengths, 푙[BN]
420
+ s
421
+ = 4.0 ± 2.5 nm
422
+ and 푙[GR]
423
+ s
424
+ = 27 ± 10 nm, and compares them against previ-
425
+ ously reported results for neat water [28]. With the slip in
426
+ GR nanochannels being approximately an order of magnitude
427
+ larger than the slip in BN nanochannels, it is clear that the
428
+ qualitative results do not change significantly with the addi-
429
+ tion of salt. The material-dependency of 푙s has been observed
430
+ in various contexts experimentally [32, 63–66] and is gen-
431
+ erally understood to arise from a decoupling of structure and
432
+ dynamics, though the precise physical mechanism is debated
433
+ [28, 35, 61, 67–69]. Quantitatively, our simulations also sug-
434
+ gest a decrease in slip as salt is added, which is consistent with
435
+ other observations for slip on hydrophobic surfaces, where
436
+ increasing fluid-wall friction results as a consequence of en-
437
+ hanced equilibrium force fluctuations from the heterogeneous
438
+ solution. [70–72].
439
+ More detailed insight into the differences in transport char-
440
+ acteristics between BN and GR nanochannels can be obtained
441
+ by computing the spatially-dependent hydraulic mobility us-
442
+ ing Eq. 4. The results of this calculation for GR and BN are
443
+ shown in Fig 3 (a). We also show the hydrodynamic mobility
444
+ profiles calculated from Eq. 6 for comparison to the macro-
445
+ scopic theory. As expected for the conductivity, we observe
446
+ approximately an order of magnitude difference between the
447
+ peaks in the hydraulic mobilities in the BN and GR nanochan-
448
+ nels. The mobility profile is nearly flat for GR and exhibits a
449
+ slight curvature for BN, indicative of the differences in slip. In
450
+ the boundary region, the mobility profile qualitatively mimics
451
+ the fluid density profile with greater (lesser) flux coinciding
452
+ with density peaks (troughs).
453
+ We find that the molecular interfacial structure also affects
454
+ the cross-terms in the mobility matrix in Eq. 2. The stream-
455
+ ing mobility 푗푄, which quantifies the electrical current pro-
456
+ file produced by applying a pressure differential, is shown in
457
+ Fig 3(b) for both systems. We observe the emergence of three
458
+ layers of electrical current of alternating sign near the fluid
459
+ wall boundary, and no net current in the bulk of the chan-
460
+ nel. Because the applied pressure produces particle flux in all
461
+ nanochannel regions, the alternating current is caused by ion
462
+ density localization at the interface, with positive (negative)
463
+ current where potassium (chloride) ions are enriched. These
464
+ interfacial effects decay away from the wall more slowly than
465
+ those observed with the hydraulic mobility, with net charge
466
+ flux penetrating into the hydrodynamic region defined by the
467
+ hydraulic mobility.
468
+ By integrating the mobility across the
469
+ channel, we find that the streaming conductivity 퐽푄 is statis-
470
+ tically indistinguishable from zero for both materials, indicat-
471
+ ing no net ionic transport. Though not shown, our calculations
472
+ verify the lack of symmetry between cross-term mobilities,
473
+ with 푞퐽 being zero at all points in the channel, within sta-
474
+ tistical accuracy, consistent withq 푞퐽 ≠ 푗푄 while main-
475
+ taining 푄퐽 = 퐽푄.
476
+ The pressure driven excess water mobility 푑푄, is shown
477
+ in Fig. 3(c) as computed using Eq. 4 for both materials. This
478
+ quantity is directly related to the desalination capabilities of
479
+ a nanofluidic channel, and its magnitude determined by the
480
+ channel’s selectivity and permeability. This transport is sum-
481
+ marized by the integrated mobility, 푑푄, with 푑푄 > 0 cor-
482
+ responding to the selective flux of water through the channel.
483
+ We find a positive integrated value 푑푄 > 0 for both materials,
484
+ demonstrating a preferential water selectivity and correspond-
485
+ ing salt rejection capability.
486
+ The spatial dependence of the cross-term mobility pro-
487
+ files can be understood via a combination of microscopic and
488
+ macroscopic perspectives.
489
+ The streaming mobility may be
490
+ evaluated microscopically as a product of the local density pro-
491
+ files and the hydraulic mobility. For the streaming mobility
492
+ this is, 푗푄(푧) = [휌K+(푧) − 휌Cl+(푧)]∕휌tot(푧)푞푄(푧)푁∕푉 ,
493
+ where 휌tot(푧) = 휌w(푧) + 휌K+(푧) + 휌Cl−(푧). Though a common
494
+ decomposition in macroscopic hydrodynamics, this is a non-
495
+ trivial statement when considering the microscopic mobilities.
496
+ The red dashed line in Fig. 3(b) shows this estimate agrees
497
+
498
+ a)
499
+ nm
500
+ ps
501
+ 0.2
502
+ mol
503
+ kJ
504
+ 0.1 :
505
+ ob1
506
+ M
507
+ 0.0
508
+ 2
509
+ 0
510
+ 1
511
+ 3
512
+ 5
513
+ 4
514
+ b)
515
+ 0.1
516
+ e
517
+ ps
518
+ 0.0
519
+ M
520
+ -0.1
521
+
522
+ 2
523
+ 3
524
+ 1
525
+ 4
526
+ 5
527
+ c)
528
+ 10
529
+ ps
530
+ 5
531
+ 1dQ
532
+ M
533
+ 0
534
+ 0
535
+ 2
536
+ 3
537
+ 1
538
+ 4
539
+ 5
540
+ nm
541
+ nm5
542
+ FIG. 4. Estimates of (a) hydraulic conductivity and (b) water selec-
543
+ tivity in simple GR (black) and BN (blue) nanochannels versus chan-
544
+ nel height 퐻. Red shaded regions indicate channel heights where
545
+ boundary effects from confining walls interact, meaning our estimate
546
+ is most reliable for 퐻 ≳ 2 nm.
547
+ well with estimate using Eq. 4. The same functional decom-
548
+ position holds for the excess water flux, which can be obtained
549
+ from the product of the hydraulic mobility and the excess water
550
+ density 푑푄(푧) = (휌w(푧)∕휌tot(푧) − ̄휌w∕ ̄휌tot
551
+ ) 푞푄(푧)푁∕푉 .
552
+ This decomposition is shown in the red dashed line in
553
+ Fig. 3(c). Both of these decompositions follow directly from
554
+ the Langevin equations of motion. While the excess water mo-
555
+ bilities for both materials are qualitatively similar because of
556
+ qualitatively similar equilibrium density distributions and hy-
557
+ draulic mobility profiles, the quantitative difference arises due
558
+ to the differences in magnitude of the hydraulic conductivity.
559
+ The first contact layer is nearly salt free, so while interfacial
560
+ friction slows pressure driven transport, the high water purity
561
+ gives a large peak in excess water mobility. There is a sec-
562
+ ond excess water mobility peak near the second water density
563
+ peak. The enrichment and depletion of chloride and potas-
564
+ sium, respectively, brings the overall salt density close to its
565
+ bulk value and leaves an excess concentration of water where
566
+ the hydraulic mobility also peaks.
567
+ The molecular dynamics calculations suggest that the trans-
568
+ port properties of the nanochannel can be decomposed as a
569
+ sum of a molecular interfacial component, and a continuum
570
+ bulk component. The interfacial component depends sensi-
571
+ tively on specific molecular interactions as they manifest in
572
+ non-uniform density profiles. Beyond the domain of those
573
+ density correlations, which for these channels extend around
574
+ 2 nm into the channel, the transport is well described by
575
+ Poiseuille flow with a large slip length. This decomposition
576
+ allows us to infer the height dependence of the channel’s se-
577
+ lectivity and permeability. We can calculate the size depen-
578
+ dent conductivity using an integrated mobility 푄푄(퐻) =
579
+ 2 ∫ 퐻∕2
580
+ 0
581
+ 푑푧 푞푄(푧)∕퐻, where we employ the inversion sym-
582
+ metry of the channel to integrate over only half of the channel.
583
+ These conductivities are shown for BN and GR in Fig. 4(a)
584
+ normalized against [GR]
585
+ 푄푄 . The red regions in Fig. 4 indicate
586
+ system sizes which would lead to overlapping interfacial re-
587
+ gions, for which our decomposition is not anticipated to be
588
+ valid.
589
+ Because the hydraulic mobility profile is nearly flat
590
+ in the hydrodynamic region, which is expected when 푙푠 ≫
591
+ 퐻hyd∕6, the overall permeability increases linearly with chan-
592
+ nel height, which is not as fast as anticipated from traditional
593
+ hydrodynamics with a no-slip boundary condition.
594
+ A similar approach can be used to compute the depen-
595
+ dency of the water selectivity on the height of the chan-
596
+ nel.
597
+ To compute the selectivity, we first can determine
598
+ a pressure driven salt mobility s푄(푧)
599
+ =
600
+ [휌K+(푧) +
601
+ 휌Cl−(푧)]∕휌tot(푧)푞푄(푧)푁∕푉 . The ratio of salt to total par-
602
+ ticle flux as a function of channel height is obtained as
603
+ 푓salt(퐻) =
604
+ ∫ 퐻∕2
605
+ 0
606
+ 푑푧 s푄(푧)
607
+
608
+ 푉 ∫ 퐻∕2
609
+ 0
610
+ 푑푧 푞푄(푧)
611
+ (8)
612
+ which is shown in Fig. 4(b) normalized against the overall
613
+ number fraction of ions in the bulk, ̄푓salt = ( ̄휌K+ + ̄휌Cl−)∕ ̄휌tot.
614
+ This provides a direct measurement of the size dependence
615
+ of the nanochannel selectivity. Consistent with the inference
616
+ from the excess water mobility, the salt flux is supressed rela-
617
+ tive to its expected value from the bulk concentration of ions
618
+ and the total channel conductivity. We find that BN and GR
619
+ nanochannels have effectively identical selectivities, primar-
620
+ ily because of their similar equilibrium fluid density distribu-
621
+ tions and qualitatively similar hydraulic mobility profiles. For
622
+ the nanochannel size and ion concentrations considered here,
623
+ the flux of salt ions is reduced by approximately 25%, while
624
+ shrinking the nanochannel until interfacial regions overlap at
625
+ around 2 nm could provide a reduction of around 50%. Due to
626
+ the intrinsic interfacial absorption of ions to the interface and
627
+ their resultant suppressed mobility, as the nanochannel size is
628
+ decreased its selectivity is enhanced. An optimal desalination
629
+ device must separate ions from water with both high selectiv-
630
+ ity as well as high permeability, and these phenomenological
631
+ channel scaling observations suggests that for both BN and GR
632
+ this optimum is between 2 and 5 nm.
633
+ This mechanism of selective transport, and the ability of
634
+ the channel to separate salt from water, is a result of an in-
635
+ terplay between local molecular interactions that drive ions to
636
+ the fluid-solid boundary in the absence of a net surface charge
637
+ of the substrate. These molecular interfacial features estab-
638
+ lished a nonuniform fluid composition across the channel that,
639
+ when combined with a spatially resolved evaluation of the hy-
640
+ draulic mobilities, provide a complete description of the trans-
641
+ port within the nanochannel. The promise of this mechanism
642
+ for desalination technology is strikingly enhanced when this
643
+ water selectivity is coupled with the anomalously high perme-
644
+ ability of GR nanochannels. This framework is general and
645
+
646
+ a)
647
+ 1.0
648
+ 8
649
+ L
650
+ 0.5
651
+ 可Q
652
+ L
653
+ 0.0
654
+ b)
655
+ 1.0
656
+ Tsalt
657
+ 0.5
658
+ Jsalt
659
+ 4
660
+ 0.0
661
+ 0
662
+ 1
663
+ 2
664
+ 3
665
+ 4
666
+ 5
667
+ H
668
+ nm6
669
+ can be used to understand and engineer other functionality in
670
+ nanofluidic systems. Employing recent generalizations of re-
671
+ sponse theory,[73–75] our approach could be extended outside
672
+ the regime of linear response to provide insight into perfor-
673
+ mance at high driving strengths and between multiple driving
674
+ forces.
675
+ Acknowledgments – This study is based on the work sup-
676
+ ported by the U.S. Department of Energy, Office of Science,
677
+ Office of Advanced Scientific Computing Research, Scientific
678
+ Discovery through Advanced Computing (SciDAC) program,
679
+ under Award No. DE-AC02-05CH11231. A. R. P was also
680
+ supported by the Heising-Simons Fellowship from the Kavli
681
+ Energy Nanoscience Institute at UC Berkeley and D. T. L ac-
682
+ knowledges support from the Alfred P. Sloan Foundation.
683
+ Data availability – The source code for the calculations
684
+ done and all data presented in this work are openly available
685
+ on Zenodo at https://doi.org/10.5281/zenodo.7522996 [57]
686
+ ∗ dlimmer@berkeley.edu
687
+ [1] L. Bocquet and E. Charlaix, Chemical Society Reviews 39, 1073
688
+ (2010).
689
+ [2] L. Bocquet, Nature materials 19, 254 (2020).
690
+ [3] J. C. Eijkel and A. v. d. Berg, Microfluidics and Nanofluidics 1,
691
+ 249 (2005).
692
+ [4] L. I. Segerink and J. C. Eijkel, Lab on a Chip 14, 3201 (2014).
693
+ [5] J. Gao, Y. Feng, W. Guo, and L. Jiang, Chemical Society Re-
694
+ views 46, 5400 (2017).
695
+ [6] Z. Zhang, L. Wen, and L. Jiang, Nature Reviews Materials 6,
696
+ 622 (2021).
697
+ [7] S. J. Kim, S. H. Ko, K. H. Kang, and J. Han, Nature nanotech-
698
+ nology 5, 297 (2010).
699
+ [8] P. Robin, N. Kavokine,
700
+ and L. Bocquet, Science 373, 687
701
+ (2021).
702
+ [9] Y. Hou and X. Hou, Science 373, 628 (2021).
703
+ [10] Q. Sheng, Y. Xie, J. Li, X. Wang, and J. Xue, Chemical Com-
704
+ munications 53, 6125 (2017).
705
+ [11] J. S. Hub and B. L. De Groot, Proceedings of the National
706
+ Academy of Sciences 105, 1198 (2008).
707
+ [12] K. Murata, K. Mitsuoka, T. Hirai, T. Walz, P. Agre, J. B. Hey-
708
+ mann, A. Engel, and Y. Fujiyoshi, Nature 407, 599 (2000).
709
+ [13] X.-C. Chen, H. Zhang, S.-H. Liu, Y. Zhou, and L. Jiang, ACS
710
+ nano (2022).
711
+ [14] Z. Zhang, X. Huang, Y. Qian, W. Chen, L. Wen, and L. Jiang,
712
+ Advanced Materials 32, 1904351 (2020).
713
+ [15] H. G. Park and Y. Jung, Chemical Society Reviews 43, 565
714
+ (2014).
715
+ [16] R. B. Schoch, J. Han,
716
+ and P. Renaud, Reviews of modern
717
+ physics 80, 839 (2008).
718
+ [17] H. Daiguji, Chemical Society Reviews 39, 901 (2010).
719
+ [18] A. Siria, M.-L. Bocquet,
720
+ and L. Bocquet, Nature Reviews
721
+ Chemistry 1, 1 (2017).
722
+ [19] H. B. Park, J. Kamcev, L. M. Robeson, M. Elimelech, and B. D.
723
+ Freeman, Science 356, eaab0530 (2017).
724
+ [20] L. M. Robeson, Journal of membrane science 320, 390 (2008).
725
+ [21] L. M. Robeson, Journal of membrane science 62, 165 (1991).
726
+ [22] A. R. Poggioli, A. Siria, and L. Bocquet, J. Phys. Chem. B 123,
727
+ 1171 (2019).
728
+ [23] R. Zhou, C. Sun, and B. Bai, The Journal of Chemical Physics
729
+ 154, 074709 (2021).
730
+ [24] L. Bocquet and J.-L. Barrat, Physical review E 49, 3079 (1994).
731
+ [25] L. Bocquet and J.-L. Barrat, Soft matter 3, 685 (2007).
732
+ [26] S. Chen, H. Wang, T. Qian, and P. Sheng, Physical Review E
733
+ 92, 043007 (2015).
734
+ [27] D. T. Limmer, C. Y. Gao, and A. R. Poggioli, The European
735
+ Physical Journal B 94, 1 (2021).
736
+ [28] A. R. Poggioli and D. T. Limmer, The journal of physical chem-
737
+ istry letters 12, 9060 (2021).
738
+ [29] Y. Yang, P. Dementyev, N. Biere, D. Emmrich, P. Stohmann,
739
+ R. Korzetz, X. Zhang, A. Beyer, S. Koch, D. Anselmetti, et al.,
740
+ ACS nano 12, 4695 (2018).
741
+ [30] G. Hummer, J. C. Rasaiah, and J. P. Noworyta, nature 414, 188
742
+ (2001).
743
+ [31] A. Keerthi, S. Goutham, Y. You, P. Iamprasertkun, R. A. Dryfe,
744
+ A. K. Geim,
745
+ and B. Radha, Nature communications 12, 1
746
+ (2021).
747
+ [32] E. Secchi, S. Marbach, A. Niguès, D. Stein, A. Siria,
748
+ and
749
+ L. Bocquet, Nature 537, 210 (2016).
750
+ [33] K. Falk, F. Sedlmeier, L. Joly, R. R. Netz, and L. Bocquet, Nano
751
+ letters 10, 4067 (2010).
752
+ [34] M. Neek-Amal, A. Lohrasebi, M. Mousaei, F. Shayeganfar,
753
+ B. Radha, and F. Peeters, Applied Physics Letters 113, 083101
754
+ (2018).
755
+ [35] G. Tocci, L. Joly, and A. Michaelides, Nano letters 14, 6872
756
+ (2014).
757
+ [36] G. Tocci, M. Bilichenko, L. Joly, and M. Iannuzzi, Nanoscale
758
+ 12, 10994 (2020).
759
+ [37] A. Boretti, S. Al-Zubaidy, M. Vaclavikova, M. Al-Abri,
760
+ S. Castelletto, and S. Mikhalovsky, npj Clean Water 1, 1 (2018).
761
+ [38] E. Y. Ang, W. Toh, J. Yeo, R. Lin, Z. Liu, K. Geethalakshmi,
762
+ and T. Y. Ng, Journal of Membrane Science 598, 117785 (2020).
763
+ [39] P. Sun, K. Wang, and H. Zhu, Advanced materials 28, 2287
764
+ (2016).
765
+ [40] Y. Li, Z. Li, F. Aydin, J. Quan, X. Chen, Y.-C. Yao, C. Zhan,
766
+ Y. Chen, T. A. Pham, and A. Noy, Science advances 6, eaba9966
767
+ (2020).
768
+ [41] D. Cohen-Tanugi and J. C. Grossman, Nano letters 12, 3602
769
+ (2012).
770
+ [42] S. C. O’Hern, M. S. Boutilier, J.-C. Idrobo, Y. Song, J. Kong,
771
+ T. Laoui, M. Atieh, and R. Karnik, Nano letters 14, 1234 (2014).
772
+ [43] Y. Liu, D. Xie, M. Song, L. Jiang, G. Fu, L. Liu, and J. Li,
773
+ Carbon 140, 131 (2018).
774
+ [44] J. M. Montes de Oca, J. Dhanasekaran, A. Córdoba, S. B. Dar-
775
+ ling, and J. J. De Pablo, ACS nano 16, 3768 (2022).
776
+ [45] B. Mi, Science 343, 740 (2014).
777
+ [46] L. Joly, R. H. Meißner, M. Iannuzzi, and G. Tocci, ACS nano
778
+ 15, 15249 (2021).
779
+ [47] E. Mangaud and B. Rotenberg, The Journal of Chemical Physics
780
+ 153, 044125 (2020).
781
+ [48] M. V. Agnihotri, S.-H. Chen, C. Beck, and S. J. Singer, The
782
+ Journal of Physical Chemistry B 118, 8170 (2014).
783
+ [49] S. Viscardy, J. Servantie, and P. Gaspard, The Journal of chem-
784
+ ical physics 126, 184512 (2007).
785
+ [50] V. Solozhenko, G. Will, and F. Elf, Solid state communications
786
+ 96, 1 (1995).
787
+ [51] N. Ooi, A. Rairkar, and J. B. Adams, Carbon 44, 231 (2006).
788
+ [52] J. L. Abascal and C. Vega, The Journal of chemical physics 123,
789
+ 234505 (2005).
790
+ [53] J.-P. Ryckaert, G. Ciccotti, and H. J. Berendsen, Journal of com-
791
+ putational physics 23, 327 (1977).
792
+ [54] T. Yagasaki, M. Matsumoto, and H. Tanaka, Journal of Chem-
793
+ ical Theory and Computation 16, 2460 (2020).
794
+ [55] A. Kayal and A. Chandra, The Journal of Physical Chemistry C
795
+
796
+ 7
797
+ 123, 6130 (2019).
798
+ [56] S. Plimpton, Journal of computational physics 117, 1 (1995).
799
+ [57] P. Helms, A. Poggioli, and D. T. Limmer, “Code and data for
800
+ "intrinsic interface adsorption drives selectivity in atomically
801
+ smooth nanofluidic channels",” (2023).
802
+ [58] M. Pykal, M. Langer, B. Blahová Prudilová, P. Banáš,
803
+ and
804
+ M. Otyepka, The Journal of Physical Chemistry C 123, 9799
805
+ (2019).
806
+ [59] J. Elliott, A. A. Papaderakis, R. Dryfe, and P. Carbone, Journal
807
+ of Materials Chemistry C (2022).
808
+ [60] J. Dockal, F. Moucka, and M. Lísal, The Journal of Physical
809
+ Chemistry C 123, 26379 (2019).
810
+ [61] F. L. Thiemann, C. Schran, P. Rowe, E. A. Müller,
811
+ and
812
+ A. Michaelides, ACS nano 16, 10775 (2022).
813
+ [62] T. Mouterde, A. Keerthi, A. R. Poggioli, S. A. Dar, A. Siria,
814
+ A. K. Geim, L. Bocquet, and B. Radha, Nature 567, 87 (2019).
815
+ [63] E. Secchi, A. Niguès, L. Jubin, A. Siria, and L. Bocquet, Phys-
816
+ ical review letters 116, 154501 (2016).
817
+ [64] J. K. Holt, H. G. Park, Y. Wang, M. Stadermann, A. B.
818
+ Artyukhin, C. P. Grigoropoulos, A. Noy, and O. Bakajin, Sci-
819
+ ence 312, 1034 (2006).
820
+ [65] Q. Xie, M. A. Alibakhshi, S. Jiao, Z. Xu, M. Hempel, J. Kong,
821
+ H. G. Park,
822
+ and C. Duan, Nature nanotechnology 13, 238
823
+ (2018).
824
+ [66] M. Majumder, N. Chopra, R. Andrews, and B. J. Hinds, Nature
825
+ 438, 44 (2005).
826
+ [67] S. Faucher, N. Aluru, M. Z. Bazant, D. Blankschtein, A. H.
827
+ Brozena, J. Cumings, J. Pedro de Souza, M. Elimelech, R. Ep-
828
+ sztein, J. T. Fourkas, et al., The Journal of Physical Chemistry
829
+ C 123, 21309 (2019).
830
+ [68] A. T. Bui, F. L. Thiemann, A. Michaelides, and S. J. Cox, arXiv
831
+ preprint arXiv:2210.14040 (2022).
832
+ [69] N. Kavokine, M.-L. Bocquet, and L. Bocquet, Nature 602, 84
833
+ (2022).
834
+ [70] C. Bakli and S. Chakraborty, The Journal of chemical physics
835
+ 138, 054504 (2013).
836
+ [71] J.-L. Barrat et al., Faraday discussions 112, 119 (1999).
837
+ [72] L. Joly, C. Ybert, E. Trizac, and L. Bocquet, Physical review
838
+ letters 93, 257805 (2004).
839
+ [73] C. Y. Gao and D. T. Limmer, The Journal of chemical physics
840
+ 151, 014101 (2019).
841
+ [74] D. Lesnicki, C. Y. Gao, B. Rotenberg, and D. T. Limmer, Phys-
842
+ ical review letters 124, 206001 (2020).
843
+ [75] D. Lesnicki, C. Y. Gao, D. T. Limmer, and B. Rotenberg, The
844
+ Journal of chemical physics 155, 014507 (2021).
845
+
ENE2T4oBgHgl3EQf9wlw/content/tmp_files/load_file.txt ADDED
The diff for this file is too large to render. See raw diff
 
GtE4T4oBgHgl3EQfHgy3/content/2301.04904v1.pdf ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:daa643c375907101e2a95b13947a7e069e4ea8dd574e5ac761e5b01effb11032
3
+ size 1044247
GtE4T4oBgHgl3EQfHgy3/vector_store/index.faiss ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:52ff3454552d4518b684a507c70708f6d1c92a9769804d0ba97dbbe3ffdddc09
3
+ size 3473453
GtE4T4oBgHgl3EQfHgy3/vector_store/index.pkl ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:1646b978256d9b853bbb322ec07f4a401f4d4e4848b5ae62c4a1c2a8c734204b
3
+ size 107051
J9E3T4oBgHgl3EQfvQsy/content/2301.04691v1.pdf ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:ad532a9034f43938022f4d0fac36efdd49b95b623053cc524f579e179cf2a80b
3
+ size 2311819
J9E3T4oBgHgl3EQfvQsy/vector_store/index.faiss ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:a4a83ef599a1f937946ce9179d72cf39ff32f80a4b4da450754ae1249de19b6a
3
+ size 4653101
J9E5T4oBgHgl3EQfXw8r/content/tmp_files/2301.05568v1.pdf.txt ADDED
@@ -0,0 +1,1906 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Nonreciprocal Cahn-Hilliard equations emerging as one of eight universal amplitude equations
2
+ Tobias Frohoff-H¨ulsmann1, ∗ and Uwe Thiele1, 2, †
3
+ 1Institut f¨ur Theoretische Physik, Westf¨alische Wilhelms-Universit¨at M¨unster, Wilhelm-Klemm-Str. 9, 48149 M¨unster, Germany
4
+ 2Center for Nonlinear Science (CeNoS), Westf¨alische Wilhelms-Universit¨at M¨unster, Corrensstr. 2, 48149 M¨unster, Germany
5
+ Oscillatory behavior is ubiquitous in out-of-equilibrium systems showing spatio-temporal pattern formation.
6
+ Starting from a large-scale linear oscillatory instability – a conserved-Hopf instability – that naturally occurs in
7
+ systems with two conservation laws, we derive the corresponding amplitude equation. This completes the set
8
+ of such universal equations for the eight types of instabilities in homogeneous isotropic systems resulting from
9
+ the combination of three features: large-scale vs. small-scale instability, stationary vs. oscillatory instability, and
10
+ instability without and with conservation law(s). The derived universal equation generalizes a phenomenological
11
+ model of considerable recent interest, namely, the nonreciprocal Cahn-Hilliard equation, and plays a similar role
12
+ in the systematics of pattern formation as the complex Ginzburg-Landau equation.
13
+ The concept of active matter emerged as a paradigm in the
14
+ description of a wide variety of biochemophysical phenomena
15
+ on multiple scales ranging from the collective behaviour of
16
+ molecules within biological cells to the dynamics of tissues or
17
+ human crowds [14]. In a narrow interpretation, active matter
18
+ always involves chemo-mechanical coupling and shows some
19
+ kind of self-sustained (collective) motion of the microscopic
20
+ ingredients [7, 33, 48, 51]. In a wider sense, active systems
21
+ encompass open systems that are kept out of equilibrium by
22
+ a troughflow of energy [35], and therefore may develop self-
23
+ organized patterns of states and/or motion. This then includes
24
+ the large spectrum of systems described by reaction-diffusion
25
+ models [28, 30, 44] and systems characterized by the interplay
26
+ of phase separation and chemical reactions [5].
27
+ In this context, predator-prey-type nonreciprocal interac-
28
+ tions between constituents of active matter have recently be-
29
+ come a particular focus as the implied breaking of Newton’s
30
+ third law results in a rich spectrum of nascent self-excited dy-
31
+ namic behaviour [10, 17, 23, 29, 36]. Beside various (stochas-
32
+ tic) agent-based models of Langevin-type also continuous de-
33
+ terministic field theories have been proposed, most notably, in
34
+ the form of nonreciprocal Cahn-Hilliard models [16, 47, 56].
35
+ The latter add nonreciprocal interactions to classical Cahn-
36
+ Hilliard models [9] (model-B in [20]) that describe the dy-
37
+ namics of phase-separation e.g. in binary or ternary mixtures
38
+ [32, 37].
39
+ In particular, the resulting nonreciprocal Cahn-
40
+ Hilliard models represent two conservation laws with nonva-
41
+ riational coupling. It is shown that this coupling may result in
42
+ coarsening traveling and oscillatory states [16, 47, 56], arrest
43
+ or suppression of coarsening [16], formation of small-scale
44
+ spatial (Turing) patterns as well as stationary, traveling and
45
+ oscillatory localised states [15] - all features forbidden in stan-
46
+ dard reciprocal Cahn-Hilliard models.
47
+ However, the nonreciprocal Cahn-Hilliard model is intro-
48
+ duced on phenomenological grounds by symmetry considera-
49
+ tions, but no derivation of the field theory from a microscopic
50
+ description or other deeper justification has been provided yet.
51
+ Here, we show that the model indeed merits extensive study
52
+ ∗ t froh01@uni-muenster.de; ORCID ID: 0000-0002-5589-9397
53
+ † u.thiele@uni-muenster.de; http://www.uwethiele.de; ORCID ID: 0000-
54
+ 0001-7989-9271
55
+ as it actually represents one of the universal equations of pat-
56
+ tern formation. One may even argue that it corresponds to
57
+ the “last missing amplitude equation” of the basic eight types
58
+ of linear instabilities in spatially extended systems. An am-
59
+ plitude (or envelope) equation describes the universal spatio-
60
+ temporal dynamics of the essential linear mode(s) in the vicin-
61
+ ity of a stability threshold, and can be systematically derived
62
+ in a weakly nonlinear approach [21]. The mentioned eight in-
63
+ stability types result from the combination of three features:
64
+ (i) large-scale vs. small-scale instability, (ii) stationary vs. os-
65
+ cillatory instability, and (iii) instability without and with con-
66
+ servation law(s). The spatial and temporal character of an in-
67
+ stability encoded in features (i) and (ii) is well captured in the
68
+ classification of instabilities by Cross and Hohenberg [11],
69
+ and the four corresponding amplitude equations for systems
70
+ without conservation law are very well studied. One exam-
71
+ ple is the complex Ginzburg-Landau equation [1] valid near
72
+ the onset of a large-scale oscillatory (aka Hopf or type IIIo
73
+ [11]) instability. An overview of the basic eight instability
74
+ types, their dispersion relations and the seven existing ampli-
75
+ tude equations is provided in section 1 of the Supplementary
76
+ Material.
77
+ However, the consequences of conservation laws in the
78
+ full range of pattern-forming systems are less well studied:
79
+ Small-scale stationary and oscillatory cases with a conserva-
80
+ tion law are considered in [34] and [53], respectively, with
81
+ applications to pattern formation in the actin cortex of motile
82
+ cells [6, 55], in crystallization [50], and in magnetoconvec-
83
+ tion [27]. However, only recently it was shown that the stan-
84
+ dard single-species Cahn-Hilliard equation does not only de-
85
+ scribe phase separation in a binary mixture but furthermore
86
+ represents the amplitude equation valid in the vicinity of a
87
+ large-scale stationary instability in a system with a conser-
88
+ vation law [2]. In consequence, close to onset, a reaction-
89
+ diffusion system with one conservation law, as e.g. discussed
90
+ in [4, 6, 8, 13, 19, 22, 52], can be quantitatively mapped onto
91
+ a Cahn-Hilliard equation. Similarly, it captures core features
92
+ of certain collective behavior in chemotactic systems [46] and
93
+ for cell polarization in eukaryotic cells [3].
94
+ This leaves only one of the eight cases unaccounted for,
95
+ namely, the large-scale oscillatory instability with conserva-
96
+ tion laws, that we call here conserved-Hopf instability. In
97
+ the following, we consider active systems with two conser-
98
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
99
+ arXiv:2301.05568v1 [nlin.PS] 13 Jan 2023
100
+
101
+ 2
102
+ vation laws and show that the corresponding universal ampli-
103
+ tude equation is a general nonreciprocal Cahn-Hilliard model.
104
+ Then, all such nonreciprocal models studied in [15, 16, 47, 56]
105
+ are recovered as special cases as is the complex Cahn-Hilliard
106
+ equation appearing as a mass-conserving limiting case in
107
+ Ref. [57].
108
+ Before we embark on the derivation of the amplitude equa-
109
+ tion we emphasize the wide spectrum of systems where the
110
+ existence of two conservation laws allows for the occurrence
111
+ of a conserved-Hopf instability and resulting intricate non-
112
+ linear oscillatory behaviour.
113
+ A prominent example is the
114
+ spatio-temporal pattern formation of proteins vital for cellu-
115
+ lar processes. Although chemical reactions cause conforma-
116
+ tion changes of proteins, their overall number is conserved on
117
+ the relevant time scale, e.g. MinE and MinD in ATP-driven
118
+ cellular Min oscillations [19]. Other relevant examples in-
119
+ clude oscillations in two-species chemotactic systems [54],
120
+ an active poroelastic model for mechanochemical waves in
121
+ cytoskeleton and cytosol [45], thin liquid layers covered by
122
+ self-propelled surfactant particles [38, 43], oscillatory coupled
123
+ lipid and protein dynamics in cell membranes [25], and heated
124
+ two-layer liquid films [42] where the two interfaces may show
125
+ intricate spatio-temporal oscillation patterns [39]. Normally,
126
+ the conserved quantities in these examples correspond to con-
127
+ centration fields, film thickness profiles, particle number den-
128
+ sities and thus the conserved-Hopf instability may occur as a
129
+ primary instability in the system. Another class of examples
130
+ exists where it appears as a secondary instability. For exam-
131
+ ple, in Marangoni convection the interaction between a large-
132
+ scale deformational and a small-scale convective instability
133
+ is described by coupled kinetic equations for the film height
134
+ and a complex amplitude[18]. There, liquid layer profile and
135
+ phase of the complex amplitude represent the two conserved
136
+ quantities and the occurring conserved-Hopf instability corre-
137
+ sponds to an oscillatory sideband instability. In all mentioned
138
+ cases two conserved quantities are present in an sustained out-
139
+ of-equilibrium setting.
140
+ Systems like the given examples that feature two conserva-
141
+ tion laws and are kept permanently out of equilibrium can be-
142
+ come unstable through a conserved-Hopf instability, i.e., the
143
+ oscillatory marginal linear mode (growth rate ∆(kc) = 0)
144
+ occurs at zero wavenumber (kc = 0) and zero frequency
145
+ (Ω(kc) = Ωc = 0). This is determined via a linear stabil-
146
+ ity analysis of the trivial uniform steady state yielding the
147
+ dispersion relations λ±(k) of the dominant pair of complex
148
+ conjugate modes where ∆ = Re λ± and Ω = ±Im λ±. Al-
149
+ though λ±(k = 0) = 0 always holds as the two conservation
150
+ laws imply the existence of two neutral modes, the mode is
151
+ nevertheless oscillatory at arbitrarily small wavenumbers, i.e.,
152
+ directly beyond instability onset the system undergoes large-
153
+ scale small-frequency oscillations. In other words, the conser-
154
+ vation laws imply that above onset the first excited mode has
155
+ the smallest wavenumber compatible with the domain bound-
156
+ aries and oscillates on a correspondingly large time scale as
157
+ Ω → 0 for k → 0. The weakly nonlinear behaviour is not
158
+ covered by any of the seven amplitude equations summarized
159
+ in section 1 of the Supplementary Material.
160
+ Corresponding dispersion relations below, at and above in-
161
+ 0
162
+ km
163
+ k +
164
+ k
165
+ 0
166
+ ∆m
167
+ ∆, Ω
168
+ ∼ ε
169
+ ∼ ε4
170
+ FIG. 1. Dispersion relations λ±(k) below (blue line, δ < 0), at
171
+ (purple line, δ = 0) and above (red line, δ > 0) the threshold of
172
+ a conserved-Hopf instability as described by the series expansion
173
+ Eq. (1). The solid lines represent the growth rate ∆ = Re λ± while
174
+ the black dashed lines give the frequencies ±Ω = Im λ± that are
175
+ identical in all three cases. Labeled thin dotted lines and solid bars
176
+ indicate typical quantities and scalings above onset as described in
177
+ the main text.
178
+ stability threshold are sketched in Fig. 1 and are at small k
179
+ given by
180
+ λ±(k) =∆(k) ± iΩ(k)
181
+ with ∆(k) =δk2 − ˜δk4 + O(k6)
182
+ (1)
183
+ and
184
+ Ω(k) =ωk2 + ˜ωk4 + O(k6).
185
+ The onset occurs when δ becomes positive while ˜δ > 0.
186
+ Above onset, Eq. (1) indicates a band 0 < k < k+ =
187
+
188
+ δ/˜δ of
189
+ exponentially growing wavenumbers with the fastest growth
190
+ at km =
191
+
192
+ δ/(2˜δ) with rate ∆m = δ2/(4˜δ).
193
+ To determine the universal kinetic equation describing the
194
+ formation of spatio-temporal patterns in the vicinity of the on-
195
+ set of a conserved-Hopf bifurcation with a dispersion relation
196
+ as depicted in Fig. 1 we apply a weakly nonlinear approach
197
+ [21]. First, we introduce a smallness parameter ε with |ε| ≪ 1
198
+ and consider the system close to onset where δ = δ2ε2. From
199
+ hereon subscript numerals indicate the order in ε of the cor-
200
+ responding term. Then, the width of the band of growing
201
+ wavenumbers and the maximal growth rate scale as ε and ε4,
202
+ respectively. This determines the additional large spatial scale
203
+ X = εx and slow timescale T = ε4t relevant for the dy-
204
+ namics. Additionally, Eq. (1) indicates that the leading order
205
+ oscillation frequency scales like Ω ≈ ωk2 ∼ ε2. This implies
206
+ that a second slow timescale τ = ε2t has to be considered.
207
+ Specifically, we now consider a homogeneous isotropic
208
+ multi-component system with two conservation laws
209
+ ∂tρ = − ∇ · (Q(u)∇η(u))
210
+ ∂tσ = − ∇ · (R(u)∇µ(u))
211
+ ∂tn =F (u),
212
+ (2)
213
+ i.e., coupled kinetic equations for two conserved (ρ and σ)
214
+ and N nonconserved [n = (n1, . . . , nN)] scalar field vari-
215
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
216
+
217
+ 3
218
+ ables. From here onwards, u = (ρ, σ, n) is used as abbrevi-
219
+ ation where convenient. The dynamics of the two conserved
220
+ quantities is given by the divergence of corresponding fluxes
221
+ that consist of the product of a mobility (Q or R) and the gra-
222
+ dient of a nonequilibrium (chemical) potential (η or µ) that
223
+ may still depend on spatial derivatives. F represents a vec-
224
+ tor of general functions of fields and their derivatives. The
225
+ system may, for instance, represent a reaction diffusion sys-
226
+ tem with N + 2 species that has been rearranged to explicitly
227
+ show the two conservation laws or a thin-film description of
228
+ an (N + 2)-component mixture where two components are
229
+ nonvolatile. For an active system the potentials can not be
230
+ obtained as variations from a single underlying energy func-
231
+ tional. Here, we sketch the derivation of the amplitude equa-
232
+ tions for a conserved-Hopf instability (Fig. 1) of a homoge-
233
+ neous steady state while section 2 of the Supplementary Ma-
234
+ terial present the complete algebra.
235
+ To perform the weakly nonlinear analysis valid in the
236
+ vicinity of instability onset, we expand all fields in ε, i.e.,
237
+ u(X, τ, T) = u0 + εu1(X, τ, T) + ε2u2(X, τ, T) + . . . ,
238
+ where u0 is the steady uniform state with F (u0) = 0 and
239
+ ui(X, τ, T), i = 1, 2, . . . are the deviations that describe the
240
+ (weakly) nonlinear behavior. We take account of the above
241
+ discussed scaling of space and time implied by the dispersion
242
+ relation by writing ∇x = ε∇X and ∂t = ε2∂τ + ε4∂T , re-
243
+ spectively. With this we then Taylor-expand all mobilities and
244
+ potentials in ε which allows us to consider Eqs. (2) order by
245
+ order. The scaling implies that we need to successively con-
246
+ sider all orders up to O(ε5) to discover evolution equations
247
+ that capture dynamic effects on the slow timescale T.
248
+ In principle, at each order we first determine the noncon-
249
+ served fields as (nonlinear) functions of the conserved fields,
250
+ reflecting that the dynamics of the former is slaved to the lat-
251
+ ter. Second, we obtain the continuity equations to the cor-
252
+ responding order by inserting the obtained expressions into
253
+ the appropriate mobilities and potentials. In particular, at or-
254
+ der ε, the contributions of the two continuity equations van-
255
+ ish and the remaining N equations become a homogeneous
256
+ linear algebraic system for the slaved quantities, solved by
257
+ n1(X, τ, T) = nρρ1(X, τ, T) + nσσ1(X, τ, T) where nρ
258
+ and nσ correspond to the zero eigenmodes (1, 0, nρ) and
259
+ (0, 1, nσ) of the dominant eigenspace at k = 0. At order ε2,
260
+ again the continuity equations are trivially fulfilled, and the
261
+ remaining equations form an inhomogeneous linear algebraic
262
+ system for the n2. Thereby, the inhomogeneity is nonlinear
263
+ in lower order quantities. At order ε3, the first nonvanishing
264
+ contributions from the continuity equations appear, that, after
265
+ eliminating n1, correspond to linear equations for ρ1 and σ1.
266
+ They provide the conditions for the instability onset at δ = 0
267
+ in Eq. (1). They also capture the leading order oscillations
268
+ with frequency ω on the time scale τ by an antisymmetric
269
+ dynamic coupling that represents a nonreciprocal coupling of
270
+ lowest order (a structure equivalent to the Schr¨odinger equa-
271
+ tion for a free particle). Also for the n3 an inhomogeneous
272
+ linear algebraic system emerges. At the subsequent order ε4,
273
+ further contributions are obtained from the continuity equa-
274
+ tions to the evolution on the time scale τ. Finally, at order
275
+ ε5 we obtain expressions for ∂T ρ1 and ∂T σ1. Using the ear-
276
+ lier obtained expressions for n1, n2, and n3, the complete
277
+ continuity equations at this order can be written as nonlinear
278
+ functions of the ρi and σi. This provides the weakly non-
279
+ linear expression for the leading order time evolution on the
280
+ timescale T. Next, the expressions found at the different or-
281
+ ders are recombined, in passing “inverting” the scalings and
282
+ Taylor expansions of time, coordinates and fields ρ and σ. The
283
+ resulting system of two coupled amplitude equations is
284
+ ∂tϱ =∇
285
+ ��
286
+ a0 + a1ϱ + a2ς + a3ϱ2 + a4ϱς + a5ς2�
287
+
288
+
289
+ α1ϱ + α2ς + α3ϱ2 + α4ϱς + α5ς2
290
+ +α6ϱ3 + α7ϱ2ς + α8ϱς2 + α9ς3 + α10∇2ϱ + α11∇2ς
291
+ ��
292
+ ,
293
+ ∂tς =∇
294
+ ��
295
+ b0 + b1ϱ + b2ς + b3ϱ2 + b4ϱς + b5ς2�
296
+
297
+
298
+ β1ϱ + β2ς + β3ϱ2 + β4ϱς + β5ς2
299
+ +β6ϱ3 + β7ϱ2ς + β8ϱς2 + β9ς3 + β10∇2ϱ + β11∇2ς
300
+ ��
301
+ ,
302
+ (3)
303
+ where all coefficients are real and well defined through Tay-
304
+ lor expansions of Q, R, η, µ, and F in Eqs. (2). The con-
305
+ served fields ϱ(x, t) and ς(x, t) describe the spatial and tem-
306
+ poral modulations in ρ(x, t) and σ(x, t) away from their re-
307
+ spective mean values ρ0 and σ0. Eqs. (3) correspond to a
308
+ general nonreciprocal two-component Cahn-Hilliard model.
309
+ Introducing rescaled time, space, ϱ and ς one may set four
310
+ parameters to specific values. In the particular case of con-
311
+ stant mobilities (Q = Q0 and R = R0), as e.g. for stan-
312
+ dard reaction-diffusion systems, one may also introduce al-
313
+ ternative conserved fields in such a way that cross-couplings
314
+ of highest order spatial derivatives are eliminated while the
315
+ overall form of Eq. (3) is kept intact. Then, also the ad-hoc
316
+ nonreciprocal Cahn-Hilliard models studied in [16, 47, 56]
317
+ emerge as special cases. The corresponding parameter choices
318
+ in Eq. (3) are given in Table III in Section 2 of the Supple-
319
+ mentary Material. There, we also include two other limit-
320
+ ing cases: (i) if certain symmetries between coefficients hold,
321
+ one may introduce a complex amplitude A = ϱ + iς and
322
+ present Eqs. (3) as a complex Cahn-Hilliard equation ∂tA =
323
+ −G∇2 �
324
+ ε + (1 + ib)∆ − (1 + ic)|A|2�
325
+ A, i.e., as a complex
326
+ Ginzburg-Landau equation with an additional outer Laplace
327
+ operator reflecting the conservation property, as briefly con-
328
+ sidered in Ref. [57]. This, in passing clarifies, that Eqs. (3)
329
+ is more general than a “conserved complex Ginzburg-Landau
330
+ equation” because it does not show its phase-shift invariance.
331
+ (ii) Imposing another symmetry between coefficients renders
332
+ the coupled equations variational.
333
+ Then they correspond
334
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
335
+
336
+ 4
337
+ to amplitude equations for certain simultaneously occurring
338
+ Cahn-Hilliard instabilities, as shown in Section 3 of the Sup-
339
+ plementary Material, and represent a generic model for the
340
+ dynamics of phase separation in a ternary system [31, 32].
341
+ To conclude, we have derived the amplitude equation valid
342
+ in the vicinity of a conserved-Hopf bifurcation - responsible
343
+ for triggering qualitative transitions in a wide variety of out-
344
+ of-equilibrium systems featuring two conservation laws. The
345
+ derived model completes the set of universal amplitude equa-
346
+ tions for the above discussed eight basic instabilities. Its im-
347
+ portance equals that of the complex Ginzburg-Landau equa-
348
+ tion that describes the universal behavior in the vicinity of
349
+ a standard Hopf bifurcaton in systems without conservation
350
+ laws [1, 11, 21, 41]. Note that the occurrence of additional
351
+ subdominant neutral modes (e.g., resulting from additional
352
+ conservation laws) or the simultaneous onset of several in-
353
+ stabilities result in higher-codimension variants of the eight
354
+ basic cases [12, 55]. Although it is known that the presented
355
+ linear instability is a phenomenon that is not covered by the
356
+ complex Ginzburg-Landau equation[38] only very few stud-
357
+ ies have considered its (weakly) nonlinear behavior by corre-
358
+ sponding amplitude equations [18, 40], normally, in special
359
+ cases. On the one hand, Ref. [18] restricts its focus to am-
360
+ plitude equations for spatially periodic traveling and standing
361
+ waves, and on the other hand, Ref. [40] deals with a partic-
362
+ ular case without reflection symmetry where one of the two
363
+ conservation laws is weakly broken. The universal charac-
364
+ ter of the model derived here, implies that literature results
365
+ on the onset of motion and oscillations [16, 47, 56] as well
366
+ as on the suppression of coarsening and the existence of lo-
367
+ calized states [15, 16] are paradigmatic for the large class of
368
+ out-of-equilibrium systems that undergo a conserved-Hopf in-
369
+ stability and will, in consequence, represent universal features
370
+ occurring in a wide variety of out-of-equilibrium systems with
371
+ conservation laws.
372
+ Acknowledgement TFH and UT acknowledge support from
373
+ the doctoral school “Active living fluids” funded by the
374
+ German-French University (Grant No.
375
+ CDFA-01-14).
376
+ In
377
+ addition, TFH thanks the foundation “Studienstiftung des
378
+ deutschen Volkes” for financial support.
379
+ [1] I. S. Aranson and L. Kramer.
380
+ The world of the complex
381
+ ginzburg-landau equation.
382
+ Rev. Mod. Phys., 74(1):99–143,
383
+ 2002.
384
+ [2] F. Bergmann, L. Rapp, and W. Zimmermann. Active phase sep-
385
+ aration: A universal approach. Phys. Rev. E, 98(2):020603(R),
386
+ 2018. doi:10.1103/PhysRevE.98.020603.
387
+ [3] F. Bergmann and W. Zimmermann.
388
+ On system-spanning
389
+ demixing properties of cell polarization.
390
+ PLoS One,
391
+ 14:e0218328, 2019.
392
+ doi:10.1371/journal.pone.
393
+ 0218328.
394
+ [4] E. Bernitt, H. G. Dobereiner, N. S. Gov, and A. Yochelis. Fronts
395
+ and waves of actin polymerization in a bistability-based mech-
396
+ anism of circular dorsal ruffles. Nat. Commun., 8:15863, 2017.
397
+ doi:10.1038/ncomms15863.
398
+ [5] J. Berry, C. P. Brangwynne, and M. Haataja. Physical principles
399
+ of intracellular organization via active and passive phase tran-
400
+ sitions. Rep. Prog. Phys., 80:046601, 2018. doi:10.1088/
401
+ 1361-6633/aaa61e.
402
+ [6] C. Beta, N. S. Gov, and A. Yochelis. Why a large-scale mode
403
+ can be essential for understanding intracellular actin waves.
404
+ Cells, 9(6):1533, 2020.
405
+ [7] M. J. Bowick, N. Fakhri, M. C. Marchetti, and S. Ramaswamy.
406
+ Symmetry, thermodynamics, and topology in active matter.
407
+ Phys. Rev. X, 12:010501, 2022. doi:10.1103/PhysRevX.
408
+ 12.010501.
409
+ [8] F. Brauns, H. Weyer, J. Halatek, J. Yoon, and E. Frey. Wave-
410
+ length selection by interrupted coarsening in reaction-diffusion
411
+ systems. Phys. Rev. Lett., 126(10):104101, 2021.
412
+ [9] J. W. Cahn.
413
+ Phase separation by spinodal decomposition in
414
+ isotropic systems. J. Chem. Phys., 42:93–99, 1965. doi:10.
415
+ 1063/1.1695731.
416
+ [10] Y. X. Chen and T. Kolokolnikov. A minimal model of predator-
417
+ swarm interactions. J. R. Soc. Interface, 11:20131208, 2014.
418
+ doi:10.1098/rsif.2013.1208.
419
+ [11] M. C. Cross and P. C. Hohenberg. Pattern formation outside of
420
+ equilibrium. Rev. Mod. Phys., 65(3):851, 1993.
421
+ [12] A. DeWit, D. Lima, G. Dewel, and P. Borckmans. Spatiotem-
422
+ poral dynamics near a codimension-two point. Phys. Rev. E,
423
+ 54:261–271, 1996. doi:10.1103/PhysRevE.54.261.
424
+ [13] S. I. Ei, H. Izuhara, and M. Mimura. Infinite dimensional relax-
425
+ ation oscillation in aggregation-growth systems. Discrete Con-
426
+ tin. Dyn. Syst.-Ser. B, 17:1859–1887, 2012. doi:10.3934/
427
+ dcdsb.2012.17.1859.
428
+ [14] X. Fang, K. Kruse, T. Lu, and J. Wang.
429
+ Nonequilib-
430
+ rium physics in biology.
431
+ Rev. Mod. Phys., 91:045004,
432
+ Dec
433
+ 2019.
434
+ URL:
435
+ https://link.aps.org/doi/
436
+ 10.1103/RevModPhys.91.045004,
437
+ doi:10.1103/
438
+ RevModPhys.91.045004.
439
+ [15] T. Frohoff-H¨ulsmann and U. Thiele. Localized states in cou-
440
+ pled Cahn–Hilliard equations. IMA J. Appl. Math., 86:924–943,
441
+ 2021. doi:10.1093/imamat/hxab026.
442
+ [16] T. Frohoff-H¨ulsmann, J. Wrembel, and U. Thiele.
443
+ Suppres-
444
+ sion of coarsening and emergence of oscillatory behavior in a
445
+ Cahn–Hilliard model with nonvariational coupling. Phys. Rev.
446
+ E, 103:042602, 2021.
447
+ doi:10.1103/PhysRevE.103.
448
+ 042602.
449
+ [17] M. Fruchart, R. Hanai, P. B. Littlewood, and V. Vitelli. Non-
450
+ reciprocal phase transitions. Nature, 592:363–369, 2021.
451
+ [18] A. A. Golovin, A. A. Nepomnyashchy, L. M. Pismen, and
452
+ H. Riecke.
453
+ Steady and oscillatory side-band instabilities in
454
+ marangoni convection with deformable interface. Physica D,
455
+ 106(1-2):131–147, 1997.
456
+ [19] J. Halatek and E. Frey.
457
+ Rethinking pattern formation in
458
+ reaction-diffusion systems. Nature Phys., 14:507–514, 2018.
459
+ doi:10.1038/s41567-017-0040-5.
460
+ [20] P. C. Hohenberg and B. I. Halperin. Theory of dynamic critical
461
+ phenomena. Rev. Mod. Phys., 49:435–479, 1977. doi:10.
462
+ 1103/RevModPhys.49.435.
463
+ [21] R. B. Hoyle. Pattern Formation – An Introduction to Methods.
464
+ University Press, Cambridge, 2006.
465
+ [22] S. Ishihara, M. Otsuji, and A. Mochizuki. Transient and steady
466
+ state of mass-conserved reaction-diffusion systems. Phys. Rev.
467
+ E, 75:015203(R), 2007.
468
+ doi:10.1103/PhysRevE.75.
469
+ 015203.
470
+ [23] A. V. Ivlev, J. Bartnick, M. Heinen, C. R. Du, V. Nosenko,
471
+ and H. L¨owen. Statistical mechanics where Newton’s third law
472
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
473
+
474
+ 5
475
+ is broken. Phys. Rev. X, 5:011035, 2015. doi:10.1103/
476
+ PhysRevX.5.011035.
477
+ [24] S. Jachalski, D. Peschka, A. M¨unch, and B. Wagner.
478
+ Im-
479
+ pact of interfacial slip on the stability of liquid two-layer poly-
480
+ mer films. J. Eng. Math., 86:9–29, 2014. doi:10.1007/
481
+ s10665-013-9651-8.
482
+ [25] K. John and M. B¨ar. Travelling lipid domains in a dynamic
483
+ model for protein-induced pattern formation in biomembranes.
484
+ Phys. Biol., 2:123–132, 2005. doi:10.1088/1478-3975/
485
+ 2/2/005.
486
+ [26] E. Knobloch.
487
+ Nonlocal amplitude equations.
488
+ In S. Kai,
489
+ editor, Pattern Formation in Complex Dissipative Systems,
490
+ pages 263–274. World Scientific, 1992.
491
+ doi:10.1142/
492
+ 9789814538039.
493
+ [27] E. Knobloch. Localized structures and front propagation in sys-
494
+ tems with a conservation law. IMA J. Appl. Math., 81(3):457–
495
+ 487, 2016. doi:10.1093/imamat/hxw029.
496
+ [28] C. Konow, M. Dolnik, and I. R. Epstein. Insights from chem-
497
+ ical systems into Turing-type morphogenesis. Philos. Trans.
498
+ R. Soc. A-Math. Phys. Eng. Sci., 379:20200269, 2021. doi:
499
+ 10.1098/rsta.2020.0269.
500
+ [29] N. P. Kryuchkov, A. V. Ivlev, and S. O. Yurchenko.
501
+ Dissi-
502
+ pative phase transitions in systems with nonreciprocal effec-
503
+ tive interactions.
504
+ Soft Matter, 14:9720–9729, 2018.
505
+ doi:
506
+ 10.1039/c8sm01836g.
507
+ [30] A. Liehr. Dissipative Solitons in Reaction Diffusion Systems:
508
+ Mechanisms, Dynamics, Interaction. Springer Series in Syner-
509
+ getics. Springer Berlin Heidelberg, 2013.
510
+ [31] Y. Q. Ma. Phase separation in ternary mixtures. J. Phys. Soc.
511
+ Jpn., 69:3597–3601, 2000.
512
+ [32] S. Mao, D. Kuldinow, M. P. Haataja, and A. Koˇsmrlj. Phase
513
+ behavior and morphology of multicomponent liquid mix-
514
+ tures.
515
+ Soft Matter, 15:1297–1311, 2019.
516
+ doi:10.1039/
517
+ c8sm02045k.
518
+ [33] M. C. Marchetti, J. F. Joanny, S. Ramaswamy, T. B. Liverpool,
519
+ J. Prost, M. Rao, and R. A. Simha.
520
+ Hydrodynamics of soft
521
+ active matter. Rev. Mod. Phys., 85:1143–1189, 2013. doi:
522
+ 10.1103/RevModPhys.85.1143.
523
+ [34] P. C. Matthews and S. M. Cox.
524
+ Pattern formation with a
525
+ conservation law. Nonlinearity, 13:1293–1320, 2000. doi:
526
+ 10.1103/PhysRevE.62.R1473.
527
+ [35] A. S. Mikhailov. Foundations of synergetics I: Distributed ac-
528
+ tive systems. Springer Verlag, Berlin, 1999.
529
+ [36] B. Nasouri and R. Golestanian. Exact phoretic interaction of
530
+ two chemically active particles. Phys. Rev. Lett., 124:168003,
531
+ 2020. doi:10.1103/physrevlett.124.168003.
532
+ [37] E. B. Nauman and D. Q. He. Nonlinear diffusion and phase
533
+ separation. Chem. Eng. Sci., 56:1999–2018, 2001. doi:10.
534
+ 1016/S0009-2509(01)00005-7.
535
+ [38] A. Nepomnyashchy and S. Shklyaev. Longwave oscillatory pat-
536
+ terns in liquids: outside the world of the complex Ginzburg-
537
+ Landau equation. J. Phys. A-Math. Theor., 49:053001, 2016.
538
+ doi:10.1088/1751-8113/49/5/053001.
539
+ [39] A. A. Nepomnyashchy and I. B. Simanovskii. Novel criteria
540
+ for the development of monotonic and oscillatory instabilities
541
+ in a two-layer film.
542
+ Phys. Fluids, 29:092104, 2017.
543
+ doi:
544
+ 10.1063/1.5001729.
545
+ [40] A. Oron and A. A. Nepomnyashchy. Long-wavelength ther-
546
+ mocapillary instability with the soret effect.
547
+ Phys. Rev.
548
+ E, 69(1):016313, 2004.
549
+ doi:10.1103/physreve.69.
550
+ 016313.
551
+ [41] L. M. Pismen. Patterns and Interfaces in Dissipative Dynam-
552
+ ics.
553
+ Springer, Berlin Heidelberg, 2006.
554
+ doi:10.1007/
555
+ 3-540-30431-2.
556
+ [42] A. Pototsky, M. Bestehorn, D. Merkt, and U. Thiele. Morphol-
557
+ ogy changes in the evolution of liquid two-layer films. J. Chem.
558
+ Phys., 122:224711, 2005. doi:10.1063/1.1927512.
559
+ [43] A. Pototsky, U. Thiele, and H. Stark. Mode instabilities and dy-
560
+ namic patterns in a colony of self-propelled surfactant particles
561
+ covering a thin liquid layer. Eur. Phys. J. E, 39(5):51, 2016.
562
+ [44] H. G. Purwins, H. U. B¨odeker, and S. Amiranashvili. Dissipa-
563
+ tive solitons. Adv. Phys., 59:485–701, 2010. doi:10.1080/
564
+ 00018732.2010.498228.
565
+ [45] M. Radszuweit, S. Alonso, H. Engel, and M. B¨ar. Intracellular
566
+ mechanochemical waves in an active poroelastic model. Phys.
567
+ Rev. Lett., 110:138102, 2013. URL: https://link.aps.
568
+ org/doi/10.1103/PhysRevLett.110.138102,
569
+ doi:10.1103/PhysRevLett.110.138102.
570
+ [46] L. Rapp and W. Zimmermann. Universal aspects of collective
571
+ behavior in chemotactic systems. Phys. Rev. E, 100:032609,
572
+ 2019. doi:10.1103/PhysRevE.100.032609.
573
+ [47] S. Saha, J. Agudo-Canalejo, and R. Golestanian.
574
+ Scalar ac-
575
+ tive mixtures: The nonreciprocal Cahn–Hilliard model. Phys.
576
+ Rev. X, 10:041009, 2020. doi:10.1103/PhysRevX.10.
577
+ 041009.
578
+ [48] M. Reza Shaebani, Adam Wysocki, Roland G. Winkler, Ger-
579
+ hard Gompper, and Heiko Rieger. Computational models for
580
+ active matter. Nat. Rev. Phys., 2:181–199, 2020. doi:10.
581
+ 1038/s42254-020-0152-1.
582
+ [49] U. Thiele, A. J. Archer, and L. M. Pismen. Gradient dynamics
583
+ models for liquid films with soluble surfactant. Phys. Rev. Flu-
584
+ ids, 1:083903, 2016. doi:10.1103/PhysRevFluids.1.
585
+ 083903.
586
+ [50] U. Thiele, A. J. Archer, M. J. Robbins, H. Gomez, and
587
+ E. Knobloch.
588
+ Localized states in the conserved Swift–
589
+ Hohenberg equation with cubic nonlinearity.
590
+ Phys. Rev.
591
+ E, 87:042915, 2013.
592
+ doi:10.1103/PhysRevE.87.
593
+ 042915.
594
+ [51] H. Wang, T. Qian, and X. Xu. Onsager’s variational princi-
595
+ ple in active soft matter. Soft Matter, 2021. doi:10.1039/
596
+ d0sm02076a.
597
+ [52] L. Wettmann, M. Bonny, and K. Kruse. Effects of molecular
598
+ noise on bistable protein distributions in rod-shaped bacteria.
599
+ Interface Focus, 4:20140039, 2014. doi:10.1098/rsfs.
600
+ 2014.0039.
601
+ [53] D. M. Winterbottom, P. C. Matthews, and S. M. Cox. Oscilla-
602
+ tory pattern formation with a conserved quantity. Nonlinearity,
603
+ 18(3):1031–1056, 2005. doi:10.1088/0951-7715/18/
604
+ 3/006.
605
+ [54] G. Wolansky.
606
+ Multi-components chemotactic system in the
607
+ absence of conflicts. Eur. J. Appl. Math., 13:641–661, 2002.
608
+ doi:10.1017/S0956792501004843.
609
+ [55] A. Yochelis, S. Flemming, and C. Beta. Versatile patterns in
610
+ the actin cortex of motile cells: Self-organized pulses can co-
611
+ exist with macropinocytic ring-shaped waves. Phys. Rev. Lett.,
612
+ 129:088101, 2022. doi:10.1103/physrevlett.129.
613
+ 088101.
614
+ [56] Z. You, A. Baskaran, and M. Marchetti.
615
+ Nonreciprocity
616
+ as a generic route to traveling states.
617
+ Proc. Natl. Acad.
618
+ Sci., 117:19767 – 19772, 2020.
619
+ doi:10.1073/pnas.
620
+ 2010318117.
621
+ [57] W. Zimmermann.
622
+ Stability of traveling waves for a con-
623
+ served field. Physica A, 237:405–412, 1997. doi:10.1016/
624
+ S0378-4371(96)00422-0.
625
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
626
+
627
+ 6
628
+ SUPPLEMENTARY MATERIAL
629
+ 1.
630
+ Dispersion relations and amplitude equations
631
+ This section of the Supplementary Material gives an overview of the eight types of linear instabilities of uniform steady states
632
+ occurring in homogeneous isotropic systems decribed by scalar field variables. In particular, we discuss the corresponding
633
+ dispersion relations and the seven well investigated amplitude equations (also called envelope equations) obtained by weakly
634
+ nonlinear theory in the vicinity of the instability thresholds.
635
+ The restriction to homogeneous isotropic systems implies that underlying model equations are translation- and rotation-
636
+ invariant. For simplicity, in the following we only consider spatially one-dimensional systems, i.e., isotropy becomes reflec-
637
+ tion symmetry (also called parity symmetry). The considered multi-component order parameter field u(x, t) represents a set of
638
+ scalars. All occurring conservation laws are assumed to be local, i.e., the kinetic equation(s) for corresponding conserved fields
639
+ ρ have the form of a continuity equation ∂tρ = −∂xj where j(x, t) is a flux that may depend linearly or nonlinearly on all
640
+ components of u(x, t) and their spatial derivatives.
641
+ Parity symmetry implies that each r.h.s. term features an even number of spatial derivatives. Here, x and t are position and
642
+ time while ∂x and ∂t are the corresponding partial derivatives.
643
+ The linear stability of steady uniform states u(x, t) = u0 is determined by adding small-amplitude perturbations that respect
644
+ the boundary conditions and show an exponential time dependence eλt. In the case of infinitely extended translation-invariant
645
+ systems, these are harmonics eikx with wavenumber k. Introducing u0 + χˆueλt+ikx with χ ≪ 1 into the kinetic equation
646
+ and linearizing in χ gives the dispersion relation λ(k) and corresponding eigenmodes ˆu. The real part ∆ = Reλ is a rate that
647
+ characterizes the exponential growth (∆ > 0) or decay (∆ < 0) of the corresponding linear mode. The imaginary part Ω := Imλ
648
+ corresponds to a frequency that can be zero (stationary case) or nonzero (oscillatory case).
649
+ nonconserved dynamics conserved dynamics
650
+ homogeneous/large-scale, stationary
651
+ Allen-Cahn (IIIs)
652
+ Cahn-Hilliard (IIs)
653
+ homogeneous/large-scale, oscillatory
654
+ Hopfa (IIIo)
655
+ conserved-Hopf (IIo)
656
+ small-scale, stationary
657
+ Turing (Is)
658
+ conserved-Turing (-)
659
+ small-scale, oscillatory
660
+ waveb (Io)
661
+ conserved-wave (-)
662
+ a Also known as “Poincar´e-Andronov-Hopf”.
663
+ b Also called “finite-wavelength Hopf”.
664
+ TABLE I. Naming convention of linear instabilities (and corresponding bifurcations) classified via their spatial (homogeneous/large-scale vs.
665
+ small-scale) and temporal (stationary vs. oscillatory) properties for the cases of nonconserved and conserved dynamics. In parentheses we give
666
+ the names in the (incomplete) classification of Cross and Hohenberg [11].
667
+ There are eight basic types of instability when basing the classification on the combination of three features: (i) large-scale vs.
668
+ small-scale instability, (ii) stationary vs. oscillatory instability, and (iii) instability without and with conservation law(s). Each
669
+ of them features typical dominant modes directly at and in the vicinity of the instability threshold. Using ε as control parameter,
670
+ the left column of Fig. 2 presents the main types in our classification by showing the dispersion relation ∆(k). In each case we
671
+ give relations below (ε < 0), at (ε = 0) and above (ε > 0) instability onset. We also indicate the critical wavenumber kc where
672
+ at onset a maximum of ∆(k) touches zero, marginal wavenumber(s) k± where Reλ(k) crosses zero above onset, and the fastest
673
+ growing wavenumber km where ∆(k) has a maximum above onset. Note for each of the four shown cases there exist a stationary
674
+ and an oscillatory variant. The right column of Fig. 2 gives the loci of k± and km in the (k, ε)-plane thereby illustrating the
675
+ band of unstable wavenumbers in its dependence on ε. Note that these dependencies are based on the leading order amplitude
676
+ equation in each case. When higher orders are included k±(ε) and km(ε) can be quantitatively different for ε ̸= 0. Our naming
677
+ convention for the eight instabilities is given in Table I. For reference, the classification of Cross and Hohenberg [11] is given,
678
+ but note that it only distinguishes six cases. Ref. [11] further states that “type II can often be scaled to resemble type I”. In
679
+ our opinion this is not correct. Also, their statements that on the one hand stationary and oscillatory instabilities have at onset
680
+ frequencies Ω = 0 and Ω = O(1), respectively, and on the other hand that type II occurs in the presence of a conservation law
681
+ seem to contradict each other, as the oscillatory case II has Ω ∼ O(ε2). In contrast, we propose a classification that takes the
682
+ importance of conservation laws directly and systematically into account.
683
+ Inspecting the first and third row of Fig. 2 we see that there are four basic instability types for nonconserved systems: If
684
+ the critical wavenumber, i.e., the marginal wavenumber at onset is zero (kc = 0) the marginal mode is homogeneous (some-
685
+ times called global) as it synchronously affects each point of the domain without any spatial modulation. We refer to it as
686
+ a homogeneous, uniform or global instability. If the corresponding critical frequency Ωc is zero [nonzero] the instability is
687
+ stationary [oscillatory]. The corresponding amplitude equations for the stationary (Allen-Cahn instability) and the oscillatory
688
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
689
+
690
+ 7
691
+ 0
692
+ 1
693
+ 2
694
+ k
695
+ 1
696
+ 0
697
+ 1
698
+
699
+ ε > 0
700
+ ε = 0
701
+ ε < 0
702
+ km = kc = 0
703
+ k +
704
+ (a)
705
+ 0
706
+ 1
707
+ 2
708
+ k
709
+ 0
710
+ 1
711
+ 2
712
+ ε
713
+ km
714
+ unstable
715
+ k +
716
+ (b)
717
+ 0
718
+ 1
719
+ 2
720
+ k
721
+ 1
722
+ 0
723
+ 1
724
+
725
+ ε > 0
726
+ ε = 0
727
+ ε < 0
728
+ km
729
+ kc
730
+ kc = 0
731
+ k +
732
+ (c)
733
+ 0
734
+ 1
735
+ 2
736
+ k
737
+ 0
738
+ 1
739
+ 2
740
+ ε
741
+ km
742
+ unstable
743
+ k +
744
+ (d)
745
+ 0
746
+ 1
747
+ 2
748
+ k
749
+ 1
750
+ 0
751
+ 1
752
+
753
+ ε > 0
754
+ ε = 0
755
+ ε < 0
756
+ km = kc
757
+ 0
758
+ k +
759
+ k −
760
+ (e)
761
+ 0
762
+ 1
763
+ 2
764
+ k
765
+ 0
766
+ 1
767
+ 2
768
+ ε
769
+ km
770
+ unstable
771
+ k −
772
+ k +
773
+ (f)
774
+ 0
775
+ 1
776
+ 2
777
+ k
778
+ 1
779
+ 0
780
+ 1
781
+
782
+ ε > 0
783
+ ε = 0
784
+ ε < 0
785
+ kc
786
+ 0
787
+ k3.5
788
+ kc
789
+ k +
790
+ k −
791
+ (g)
792
+ 0
793
+ 1
794
+ 2
795
+ k
796
+ 0
797
+ 1
798
+ 2
799
+ ε
800
+ km
801
+ unstable
802
+ k −
803
+ k +
804
+ (h)
805
+ FIG. 2. Classification of dispersion relations distinguishing large-scale and small-scale instabilities as well as instabilities without and with
806
+ conservation law(s). Shown are (left) the real part ∆ = Re λ(k) of the dispersion relation and (right) the position of marginal wavenumber(s)
807
+ k± (solid line) and fastest growing wavenumber km (dashed line) in the plane spanned by wavenumber k and control parameter ε. For each
808
+ of the four cases there exist stationary and oscillatory variants. In the left panels we also indicate the critical wavenumber kc where the
809
+ instability onset occurs (at ε = 0, heavy solid blue line). Dashed lines give ∆(k) below (ε < 0) and above (ε > 0) onset. Shown are (a,b) the
810
+ nonconserved homogeneous (Allen-Cahn and Hopf) instability, (c,d) the conserved large-scale (Cahn-Hilliard and conserved-Hopf) instability,
811
+ (e,f) the nonconserved small-scale (Turing and wave) instability, and (g,h) the conserved small-scale (conserved-Turing and conserved-wave)
812
+ instability. Naming conventions are summarizd in Table I.
813
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
814
+
815
+ 8
816
+ (Hopf instability) case are the Allen-Cahn equation
817
+ ∂tB = sgn(ε)B + ∂xxB + αB2 − B3
818
+ (4)
819
+ and the complex Ginzburg-Landau equation
820
+ ∂tA = sgn(ε)A + (1 + iκi)∂xxA − (1 + iαi)|A|2A
821
+ (5)
822
+ respectively.
823
+ Here, B(x, t) is the spatially slowly varying real amplitude of the spatially homogeneous stationary mode while A(x, t) is the
824
+ spatially slowly varying complex amplitude of the spatially homogeneous oscillatory mode at k = 0. Note that a derivation of the
825
+ universal amplitude equations results in specific coefficients for each term on the right hand side that depend on the corresponding
826
+ original model. Furthermore, the space and time variables describe spatially and temporally slow dynamics, hence, amplitude
827
+ equations are often referred to as envelope equations. Introducing a transformation of space, time and amplitude one can always
828
+ eliminate three coefficients. Here and for the following cases we give these simplified universal equations in the supercritical
829
+ cases. In the corresponding subcritical cases the cubic nonlinearity acts destabilizing, e.g. it occurs with a positive sign in Eq. (5).
830
+ Then, higher order stabilizing terms, e.g. a quintic nonlinearity, must be included to obtain a well behaved system. The sgn(ε)
831
+ function occurs since it determines whether the amplitude linearly grows or decays.
832
+ In contrast, a nonzero marginal wavenumber at onset (kc ̸= 0) indicates a small-scale instability, i.e., an instability of finite
833
+ wavelength. The amplitude equation in the stationary case (Turing instability) is the real Ginzburg-Landau equation
834
+ ∂tA = sgn(ε)A + ∂xxA − |A|2A
835
+ (6)
836
+ where A(x, t) is the slowly varying complex amplitude of the spatially periodic stationary mode at k = kc. In the oscillatory
837
+ case (wave instability) the coupled complex Ginzburg-Landau equations
838
+ ∂tA1 = sgn(ε)A1 − c∂xA1 + (1 + iκi)∂xxA1 − (1 + iαi)|A1|2A1 − (βr + iβi)|A2|2A1
839
+ ∂tA2 = sgn(ε)A2 + c∂xA2 + (1 + iκi)∂xxA2 − (1 + iαi)|A2|2A2 − (βr + iβi)|A1|2A2
840
+ (7)
841
+ emerge as amplitude equations where complex amplitudes A1 and A2 correspond to left and right traveling waves, respectively.
842
+ These equations are only valid for small group velocity c (see sec. VI.E of [1], section 7.1 of [21], sections 1 & 2 of [53]). If
843
+ this condition is not fulfilled a nonlocal equation is derived [26]. The four described cases for systems without conservation
844
+ laws are all well covered by the Cross-Hohenberg classification (as types Is, Io, IIIs, IIIo) [11] and are widely analyzed in the
845
+ literature.
846
+ However, for systems with a conservation law there are another four basic types again distinguished based on wavenumber
847
+ and mode type at onset. They are shown in the second and fourth row of Fig. 2. The conservation law results in the existence of a
848
+ neutral mode at zero wavenumber, i.e., λ = 0 at k = 0 at all values of ε. Note that the instability thresholds are equivalent to the
849
+ corresponding cases without conservation law. However, the fastest growing mode above onset behaves differently. For instance,
850
+ in the case of zero marginal wavenumber at onset (kc = 0, second row of Fig. 2, Cahn-Hilliard instability), km increases with
851
+ ε in contrast to the case of an Allen-Cahn instability. This implies that the instability is observed as a large-scale instability, not
852
+ a homogeneous one. The growth of a homogeneous mode is incompatible with a fully conserved dynamics. The corresponding
853
+ amplitude equation has only recently been systematically derived [2]. It corresponds to the Cahn-Hilliard equation (well known
854
+ from other contexts)
855
+ ∂tB = ∂xx
856
+
857
+ −sgn(ε)B + αB2 + B3 − ∂xxB
858
+
859
+ (8)
860
+ where B(x, t) is the spatially slowly varying real amplitude of the spatially homogeneous stationary mode at k = 0. Since the
861
+ Cahn-Hilliard equation is a continuity equation the total growth, i.e., the growth integrated over the domain,
862
+
863
+ dx∂tB, vanishes.
864
+ This confirms that conserved quantities can only be spatially redistributed within the domain but overall do not change.
865
+ The small-scale cases with conservation law [Fig. 2 (g,h)] are not explicitely mentioned in the Cross-Hohenberg classification
866
+ [11], but their relevance and distinct features became later more widely known [34, 53]. Here, we call the stationary and
867
+ oscillatory case conserved-Turing and conserved-wave instability, respectively. The corresponding amplitude equations in the
868
+ stationary case correspond to a real Ginzburg-Landau equation coupled to a nonlinear diffusion equation (see [34] and section 9.4
869
+ of [21])
870
+ ∂tA = sgn(ε)A + ∂xxA − |A|2A − AB
871
+ ∂tB = ∂xx
872
+
873
+ νB + µ|A|2�
874
+ .
875
+ (9)
876
+ Here, A is the slowly varying complex amplitude of a spatially periodic stationary mode and B is the real amplitude of a
877
+ spatially slowly varying stationary mode. In the oscillatory case one finds two complex Ginzburg-Landau equations (for complex
878
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
879
+
880
+ 9
881
+ amplitudes A1 and A2 of left and right traveling waves, respectively) coupled to an equation for a real scalar mode of amplitude
882
+ B (see pg. 1034 of [53]), i.e.,
883
+ ∂tA1 = sgn(ε)A1 − c∂xA1 + (1 + iκi)∂xxA1 − (1 + iαi)|A1|2A1 − (βr + iβi)|A2|2A1 − (1 + iγi)A1B
884
+ ∂tA2 = sgn(ε)A2 + c∂xA2 + (1 + iκi)∂xxA2 − (1 + iαi)|A2|2A2 − (βr + iβi)|A1|2A2 − (1 + iγi)A2B
885
+ ∂tB = ∂xx
886
+
887
+ νB + µ(|A1|2 − |A2|2)
888
+
889
+ .
890
+ (10)
891
+ Again, these are only valid for small group velocity c.
892
+ Although the presented picture might at first sight seem complete, the careful reader will have noticed that Eqs. (4) to (10) only
893
+ present the amplitude equations for seven of the eight discussed cases of linear instabilities: we have neglected the large-scale
894
+ oscillatory instability with conservation law (conserved-Hopf instability). This case is to our knowledge not yet systematically
895
+ treated in the literature, and the corresponding universal amplitude equation has not yet been systematically derived. This is the
896
+ subject of the main text.
897
+ 2.
898
+ Derivation of amplitude equation for conserved-Hopf instability
899
+ To provide the detailed derivation of the general nonreciprocal Cahn-Hilliard equation as amplitude equation for the
900
+ conserved-Hopf instability, i.e., a large-scale oscillatory instability in systems with conservation law, we consider a reflection-
901
+ symmetric multi-component system. It is written as coupled kinetic equations for two conserved (ρ and σ) and N nonconserved
902
+ (n = (n1, . . . , nN)) scalar field variables
903
+ ∂tρ = − ∂x (Q(u)∂xη(u))
904
+ ∂tσ = − ∂x (R(u)∂xµ(u))
905
+ ∂tn =F (u).
906
+ (11)
907
+ Form here onwards u = (ρ, σ, n) is used as abbreviation where convenient. The dynamics of the conserved quantities is
908
+ determined by the divergence of the corresponding fluxes. Each flux is the product of a mobility function (Q and R, respectively)
909
+ and the gradient of a potential (η and µ, respectively). In general, these are nonequilibrium (chemical) potentials that can not be
910
+ obtained as variations from a single underlying energy functional. This renders the system active. For scalar fields, reflection
911
+ symmetry implies that Eqs. (11) are invariant under the transformation x → −x. Therefore, the individual terms within the
912
+ potentials η and µ do either not include derivatives or an even number of them. Normally, the mobilities are assumed to be
913
+ functions of the fields, but terms with an even number of derivatives may also be easily accommodated. Furthermore, at least
914
+ one uniform steady state u0 with F (u0) = 0 shall exist.
915
+ We consider the case of a conserved-Hopf instability, i.e., at control parameter δ = 0 the considered u0 state becomes unstable
916
+ with a dispersion relation above onset as in Fig. 1 of the main text. Note that in a system with N ≥ 2 nonconserved quantities
917
+ a standard Hopf instability is also still possible. However, then the conserved quantities do not contribute to the corresponding
918
+ linear modes, and interactions between nonconserved oscillatory and conserved real modes will only occur nonlinearly. Here,
919
+ such a setting is not considered. The conserved-Hopf instability we are here interested in always involves the branches of the
920
+ dispersion relation containing the two neutral modes at k = 0.
921
+ To perform the weakly nonlinear analysis valid in the vicinity of instability onset, i.e., for δ = δ2ε2, we expand all fields in
922
+ the smallness parameter ε ≪ 1, i.e.,
923
+ u(X, τ, T) = u0 + εu1(X, τ, T) + ε2u2(X, τ, T) + . . . ,
924
+ (12)
925
+ take account of the scaling discussed in the main text by writing ∂x = ε∂X and ∂t = ε2∂τ +ε4∂T , and also expand all quantities
926
+ occurring on the right hand side of Eqs. (11) as
927
+ Q =Q0 + εQ1 + ε2Q2 + . . .
928
+ R =R0 + εR1 + ε2R2 + . . .
929
+ η =η0 + εη1 + ε2η2 + ε3η3 + . . .
930
+ µ =µ0 + εµ1 + ε2µ2 + ε3µ3 + . . .
931
+ F =εF 1 + ε2F 2 + ε3F 3 + . . . ,
932
+ (13)
933
+ where F 0 = F (u0) = 0 was used. The various coefficients are given by corresponding Taylor expansions, e.g. Q2 = u1 ·
934
+ 1
935
+ 2
936
+ ∂2Q
937
+ ∂u2
938
+ ��
939
+ u0 · u1 + ∂Q
940
+ ∂u
941
+ ��
942
+ u0 · u2. Examples for these coefficients are given in Table II. All expansions and scalings are inserted into
943
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
944
+
945
+ 10
946
+ the model equations (11), that are then considered order by order in ε. Due to the scaling implied by the dispersion relation, one
947
+ needs to successively consider all orders up to O(ε5) to obtain evolution equations that capture dynamics effects on the slow
948
+ timescale T.
949
+ The general procedure to follow at each order i = 1, . . . , 5 is: First, determine the nonconserved fields ni as (nonlinear)
950
+ functions of the conserved fields σ and ρ, hence, consider the dynamics of the nonconserved fields that is slaved to the dynamics
951
+ of the conserved fields. Second, obtain the continuity equations to the corresponding order by inserting the expressions for ni
952
+ into the appropriate mobilities Qi, Ri and potentials ηi, µi. Finally, the dynamics for ρ and σ are combined into two coupled
953
+ amplitude equations including terms up to ∂T ρ1 and ∂T σ1, respectively. Now we proceed order by order.
954
+ a.
955
+ Order ε:
956
+ As expected, we recover the linear result at k = 0: The contributions of the two continuity equations vanish
957
+ and the remaining N equations become the algebraic system
958
+ 0 = F 1
959
+ (14)
960
+ linear in N + 2 unknown quantities u1. It is solved for
961
+ n1(X, τ, T) = nρρ1(X, τ, T) + nσσ1(X, τ, T)
962
+ (15)
963
+ where nρ and nσ correspond to the zero eigenmodes (1, 0, nρ) and (0, 1, nσ), respectively, discussed in the main text.
964
+ b.
965
+ Order ε2:
966
+ As in O(ε), the continuity equations are trivially fulfilled and the nonconserved fields give
967
+ 0 = F 2 .
968
+ (16)
969
+ These algebraic relations consist of a linear part similar to Eq. (15) but for the fields u2 and a nonlinear part quadratic in ρ1
970
+ and σ1 (after eliminating quadratic parts involving n1 via Eq. (15)). The nonlinearities correspond to the inhomogeneity of the
971
+ algebraic system for the u2. In consequence, n2 is now given as a sum of a part linear in the amplitudes ρ2 and η2 and the
972
+ nonlinearity, namely,
973
+ n2 = nρρ2 + nσσ2 + nρρρ2
974
+ 1 + nρσρ1σ1 + nσσσ2
975
+ 1 .
976
+ (17)
977
+ Here and in the following, the vectors of real constant coefficients nα, nαβ, etc. depend on the specific functions F .
978
+ c.
979
+ Order ε3:
980
+ At the next order, the first nonvanishing contribution from the continuity equations appears, resulting in the
981
+ system
982
+ ∂τρ1 = −∂X (Q0∂Xη1)
983
+ ∂τσ1 = −∂X (R0∂Xµ1)
984
+ ∂τn1 = F 3
985
+ (18)
986
+ where η1 and µ1 are linear in ρ1, σ1 and n1. For the latter we insert Eq. (15) and obtain
987
+ η1 = ηρρ1 + ησσ1
988
+ µ1 = µρρ1 + µσσ1
989
+ (19)
990
+ with real constant coefficients ηρ, ησ, µρ and µσ as exemplified in Table II that also provides further coefficients appearing at
991
+ higher orders in ε. Further, Q0, R0 are constants and inserting the expressions (19) we can write the first two equations in (18)
992
+ as a linear system
993
+ ∂τ
994
+
995
+ ρ1
996
+ σ1
997
+
998
+ = −
999
+
1000
+ Q0ηρ Q0ησ
1001
+ R0µρ R0µσ
1002
+
1003
+ ∂XX
1004
+
1005
+ ρ1
1006
+ σ1
1007
+
1008
+ .
1009
+ (20)
1010
+ Applying (ρ1, σ1) ∼ exp (ikX + λτ), its eigenvalues are
1011
+ λ± = k2 Q0ηρ + R0µσ
1012
+ 2
1013
+ ± k2
1014
+
1015
+ (Q0ηρ − R0µσ)2
1016
+ 4
1017
+ + Q0ησR0µρ .
1018
+ (21)
1019
+ Comparing to the dispersion relation (Eq. (1) of the main text) allows us to identify
1020
+ δ =Q0ηρ + R0µσ
1021
+ 2
1022
+ iω =
1023
+
1024
+ (Q0ηρ − R0µσ)2
1025
+ 4
1026
+ + Q0ησR0µρ .
1027
+ (22)
1028
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
1029
+
1030
+ 11
1031
+ At onset of the conserved-Hopf instability the growth rate δ vanishes, i.e.,
1032
+ Q0ηρ = −R0µσ
1033
+ (23)
1034
+ and the eigenvalues are purely imaginary, i.e.,
1035
+ (Q0ηρ − R0µσ)2
1036
+ 4
1037
+ + Q0ησR0µρ < 0 .
1038
+ (24)
1039
+ Using (23), this implies
1040
+ ησµρ < ηρµσ < 0,
1041
+ (25)
1042
+ and thereby defines a nonreciprocity condition for the linear coupling terms within the potentials. Since we are interested in the
1043
+ dynamics closely above [below] the instability onset where δ = δ2ε2 with δ2 > 0 [δ2 < 0], Eq. (23) only holds at leading order,
1044
+ i.e., including the next order we have Q0ηρ = −R0µσ +(2δ2 −R0µσ)ε2. This makes the result fully consistent with the scaling
1045
+ based on Eqs. (1), as the oscillations of leading order frequency ωk2 occur on the timescale τ [given that ω = O(1)] where the
1046
+ growth rate vanishes. Growth only occurs on the slower time scale T. Specifically, the O(ε2) contribution in δ is then considered
1047
+ when below discussing order ε5 terms. Here, at O(ε3), we can simply set δ = 0. With this, we now reformulate Eq. (20). Note
1048
+ that any linear combination of ρ and σ, e.g.
1049
+ A(X, τ, T) = aρρ(X, τ, T) + aσσ(X, τ, T)
1050
+ (26)
1051
+ B(X, τ, T) = bρρ(X, τ, T) + bσσ(X, τ, T) .
1052
+ (27)
1053
+ with coefficients aρ, aσ, bρ and bσ results in an equivalent formulation for alternative conserved fields A and B. We use the
1054
+ resulting freedom to simplify Eq. (20) by choosing
1055
+ bσ = −ωaρ + Q0ηρbρ
1056
+ R0µρ
1057
+ ,
1058
+ aσ = ωbρ − Q0ηρaρ
1059
+ R0µρ
1060
+ (28)
1061
+ and aρ, bρ are normalization constants. This reduces Eqs. (20) to
1062
+ ∂τ
1063
+
1064
+ A1
1065
+ B1
1066
+
1067
+ =
1068
+
1069
+ 0 −ω
1070
+ ω
1071
+ 0
1072
+
1073
+ ∂XX
1074
+
1075
+ A1
1076
+ B1
1077
+
1078
+ ,
1079
+ (29)
1080
+ i.e., the leading order oscillation is represented by an antisymmetric dynamic coupling of A and B, that represents the lowest
1081
+ order nonreciprocal coupling. The form of Eq. (29) allows one to easily show that the corresponding part of the dynamics is not
1082
+ dissipative.
1083
+ For simplicity of notation, here, we proceed with the description using the original quantities ρ and σ. It helps us to identify
1084
+ the structure of the two continuity equations in terms of Q, R, η and µ. Still at O(ε3), we determine n3 via the third equation in
1085
+ (18): we insert n1 from Eq. (15) and use Eqs. (20) for the time derivative to obtain
1086
+ n3 =nρρ3 + nσσ3 + nρρ2ρ1ρ2 + nρσ (ρ1σ2 + ρ2σ1) + nσσ2σ1σ2
1087
+ + nρρρρ3
1088
+ 1 + nρρσρ2
1089
+ 1σ1 + nρσσρ1σ2
1090
+ 1 + nσσσσ3
1091
+ 1
1092
+ + nρxx∂XXρ1 + nσxx∂XXσ1 .
1093
+ (30)
1094
+ Similar to the expression for n2 it consists of the sum of a linear part given by Eq. (15) applied to u3 and a nonlinear part that
1095
+ corresponds to an inhomogeneity.
1096
+ d.
1097
+ Order ε4:
1098
+ At the next order we obtain
1099
+ ∂τρ2 = −∂X (Q0∂Xη2) − ∂X (Q1∂Xη1)
1100
+ ∂τσ2 = −∂X (R0∂Xµ2) − ∂X (R1∂Xµ1)
1101
+ ∂τn2 = F 4
1102
+ (31)
1103
+ where additionally to the already known Q0, R0, η1 and µ1 the higher order quantities Q1, R1, η2 and µ2 enter. Using Eq. (17)
1104
+ for n2 we obtain
1105
+ Q1 =qρρ1 + qσσ1
1106
+ R1 =rρρ1 + rσσ1
1107
+ η2 =ηρρ2 + ησσ2 + ηρρρ2
1108
+ 1 + ηρσρ1σ1 + ησσσ2
1109
+ 1
1110
+ µ2 =µρρ2 + µσσ2 + µρρρ2
1111
+ 1 + µρσρ1σ1 + µσσσ2
1112
+ 1
1113
+ (32)
1114
+ Furthermore, at order ε4 one may also determine an algebraic expression for n4. However, here, we do not present it because
1115
+ it does not contribute to the relevant leading order dynamics of ρ and σ.
1116
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
1117
+
1118
+ 12
1119
+ e.
1120
+ Order ε5:
1121
+ Finally, the fifth order gives the kinetic equations
1122
+ ∂T ρ1 + ∂τρ3 = −∂X (Q0∂Xη3) − ∂X (Q1∂Xη2) − ∂X (Q2∂Xη1)
1123
+ ∂T σ1 + ∂τσ3 = −∂X (R0∂Xµ3) − ∂X (R1∂Xµ2) − ∂X (R2∂Xµ1)
1124
+ ∂T n1 + ∂τn3 = F 5 .
1125
+ (33)
1126
+ Using the already determined expressions for n1, n2 and n3 the complete right hand sides of the continuity Eqs. (33) can be
1127
+ written as nonlinear functions of the ρi and σi with coefficients defined in a similar way as at lower orders:
1128
+ Q2 =qρρ2 + qσσ2 + qρρρ2
1129
+ 1 + qρσρ1σ1 + qσσσ2
1130
+ 1
1131
+ R2 =rρρ2 + rσσ2 + rρρρ2
1132
+ 1 + rρσρ1σ1 + rσσσ2
1133
+ 1
1134
+ η3 =ηρρ3 + ησσ3 + 2ηρρρ1ρ2 + ηρσ (ρ1σ2 + ρ2σ1) + 2ησσσ1σ2
1135
+ + ηρρρρ3
1136
+ 1 + ηρρσρ2
1137
+ 1σ1 + ηρσσρ1σ2
1138
+ 1 + ησσσσ3
1139
+ 1 + ηρxx∂XXρ1 + ησxx∂XXσ1
1140
+ µ3 =µρρ3 + µσσ3 + 2µρρρ1ρ2 + µρσ (ρ1σ2 + ρ2σ1) + 2µσσσ1σ2
1141
+ + µρρρρ3
1142
+ 1 + µρρσρ2
1143
+ 1σ1 + µρσσρ1σ2
1144
+ 1 + µσσσσ3
1145
+ 1 + µρxx∂XXρ1 + µσxx∂XXσ1
1146
+ (34)
1147
+ This provides the weakly nonlinear expression for the time evolution on the timescale T. To obtain the final amplitude
1148
+ equations we combine the dynamics found at the different orders. In other words, we recombine the different orders of the
1149
+ expansion of the fields into the appropriate fields u as the deviations from the steady state u0. Specifically we introduce
1150
+ ϱ ≡ ρ − ρ0 and ς ≡ σ − σ0.
1151
+ For instance, the dynamics of ϱ is given by
1152
+ ∂tϱ =ε3∂τρ1 + ε4∂τρ2 + ε5 (∂T ρ1 + ∂τρ3) + O(ε6)
1153
+ = − ε3∂X (Q0∂Xη1) − ε4∂X (Q0∂Xη2 + Q1∂Xη1)
1154
+ − ε5∂X (Q0∂Xη3 + Q1∂Xη2 + Q2∂Xη1) + O(ε6)
1155
+ = − ε2∂X
1156
+ ��
1157
+ Q0 + εQ1 + ε2Q2
1158
+
1159
+ ∂X
1160
+
1161
+ εη1 + ε2η2 + ε3η3
1162
+ ��
1163
+ + O(ε6).
1164
+ (35)
1165
+ Note that in the last step we have added selected terms, e.g. −ε6∂X (Q2∂Xη2) that would naturally occur at higher orders of the
1166
+ derivation. However, including them in Eq. (35) obtained through considerations up to O(ε5) allows us to conserve the structure
1167
+ of a continuity equation (even with a flux that equals the product of a mobility and a gradient of a potential). We emphasize that
1168
+ this procedure does not correspond to a further approximation. The leading order terms, i.e., terms up to O(ε5) are not touched
1169
+ and adding terms that are smaller than O(ε5) does not change the validity of Eqs. (35). One may even argue that one has to
1170
+ add these terms to keep the structure as a conservation law intact. See the corresponding discussion for the related problem of a
1171
+ gradient dynamics structure in appendix A of [49].
1172
+ Furthermore, we introduce the original scales, x and t and the fields ϱ and ς, e.g.
1173
+ ηρρε2∂XX
1174
+
1175
+ ε2ρ2
1176
+ 1 + 2ε3ρ1ρ2
1177
+
1178
+ = ηρρε2∂XX
1179
+
1180
+ ερ1 + ε2ρ2
1181
+ �2 + O(ε6) = ηρρ∂xxϱ2 + O(ε6),
1182
+ (36)
1183
+ and obtain as result the coupled amplitude equations
1184
+ ∂tϱ = − ∂x
1185
+ ��
1186
+ Q0 + qρϱ + qσς + qρρϱ2 + qρσϱς + qσσς2�
1187
+ ∂x
1188
+
1189
+ ηρϱ + ησς + ηρρϱ2 + ηρσϱς + ησσς2
1190
+ +ηρρρϱ3 + ηρρσϱ2ς + ηρσσϱς2 + ησσσς3 + ηρxx∂xxϱ + ησxx∂xxς
1191
+ ��
1192
+ ∂tς = − ∂x
1193
+ ��
1194
+ R0 + rρϱ + rσς + rρρϱ2 + rρσϱς + rσσς2�
1195
+ ∂x
1196
+
1197
+ µρϱ + µσς + µρρϱ2 + µρσϱς + µσσς2
1198
+ +µρρρϱ3 + µρρσϱ2ς + µρσσϱς2 + µσσσς3 + µρxx∂xxϱ + µσxx∂xxς
1199
+ ��
1200
+ (37)
1201
+ where all coefficients are real and well defined through Taylor expansions (see Table II). By construction the mean values of ϱ and
1202
+ ς vanish, i.e.,
1203
+
1204
+ dV ϱ =
1205
+
1206
+ dV ς = 0. For the sake of readability we use another naming convention for the parameters in Eqs. (3)
1207
+ of the main text where we incorporate the overall minus sign into the coefficients of the terms in the potentials. Eqs. (37)
1208
+ correspond to a general nonreciprocal Cahn-Hilliard model. Note that all nonreciprocal Cahn-Hilliard models studied in the
1209
+ literature [16, 47, 56, 57] correspond to particular choices of relations between parameters in the derived general nonreciprocal
1210
+ Cahn-Hilliard model (37). These choices are listed in Table III.
1211
+ In matrix form Eqs. (37) read
1212
+ ∂t
1213
+
1214
+ ϱ
1215
+ ς
1216
+
1217
+ = −∂x
1218
+
1219
+ M(ϱ, ς)∂x
1220
+
1221
+ L
1222
+
1223
+ ϱ
1224
+ ς
1225
+
1226
+ +
1227
+
1228
+ Nρ(ϱ, ς)
1229
+ Nσ(ϱ, ς)
1230
+
1231
+ + D∂xx
1232
+
1233
+ ϱ
1234
+ ς
1235
+ ���
1236
+ (38)
1237
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
1238
+
1239
+ 13
1240
+ where M(ϱ, ς) is a non-constant diagonal mobility matrix, and L and D are fully occupied constant matrices that describe the
1241
+ terms within the potentials that are linear in the fields and linear in their second spatial derivatives, respectively. All nonlinearities
1242
+ within the potentials are contained in the Nρ(ϱ, ς) and Nσ(ϱ, ς). If we linearize Eqs. (38) we obtain
1243
+ ∂t
1244
+
1245
+ ϱ
1246
+ ς
1247
+
1248
+ = − ∂x
1249
+
1250
+ M(0, 0)∂x
1251
+
1252
+ L
1253
+
1254
+ ϱ
1255
+ ς
1256
+
1257
+ + D∂xx
1258
+
1259
+ ϱ
1260
+ ς
1261
+ ���
1262
+ ⇒ ∂t
1263
+
1264
+ ϱ
1265
+ ς
1266
+
1267
+ = −
1268
+
1269
+ Q0ηρ Q0ησ
1270
+ R0µρ R0µσ
1271
+
1272
+ ∂xx
1273
+
1274
+ ϱ
1275
+ ς
1276
+
1277
+
1278
+
1279
+ Q0ηρxx Q0ησxx
1280
+ R0µρxx R0µσxx
1281
+
1282
+ ∂xxxx
1283
+
1284
+ ϱ
1285
+ ς
1286
+
1287
+ .
1288
+ (39)
1289
+ Determining the eigenvalues we recover the original dispersion relation (1) as it should be. In particular, the coefficients in
1290
+ Eq. (39) are related to the ones of Eq. (1) of the main text, i.e.,
1291
+ ˜δ = − Q0ηρxx + R0µσxx
1292
+ 2
1293
+ (40)
1294
+ i˜ω =ηρηρxxQ2
1295
+ 0 + (2ησxxµρ + 2ησµρxx − ηρxxµσ − ηρµσxx)Q0R0 + µσµσxxR2
1296
+ 0
1297
+ 2
1298
+
1299
+ η2ρQ2
1300
+ 0 − 2ηρµσQ0R0 + R0(4ησµρQ0 + µ2σR0)
1301
+ (41)
1302
+ together with the already known relations for δ2 and ω from Eqs. (22). Note that in contrast to the dynamics on the timescale τ,
1303
+ here, we take the deviation from the onset of instability into account, i.e., (Q0ηρ + R0µσ)/2 = δ2ε2.
1304
+ Finally, we may remove the cross-couplings in the highest order derivatives by formulating Eqs. (38) in alternative conserved
1305
+ amplitudes
1306
+
1307
+ A
1308
+ B
1309
+
1310
+ ≡ T
1311
+
1312
+ ϱ
1313
+ ς
1314
+
1315
+ where T is the corresponding transformation matrix. Multiplying Eqs. (38) with T we rewrite
1316
+ it in the new field variables as
1317
+ ∂t
1318
+
1319
+ A
1320
+ B
1321
+
1322
+ = −∂x
1323
+
1324
+ T �
1325
+ M(A, B)T−1∂x
1326
+
1327
+ T L T−1
1328
+
1329
+ A
1330
+ B
1331
+
1332
+ + T
1333
+
1334
+
1335
+ Nρ(A, B)
1336
+
1337
+ Nσ(A, B)
1338
+
1339
+ + T D T−1∂xx
1340
+
1341
+ A
1342
+ B
1343
+ ���
1344
+ (42)
1345
+ where the quantities with tilde are obtained by e.g. M(ϱ, ς) = M(ϱ(A, B), ς(A, B)) = �
1346
+ M(A, B). If we pick a transformation
1347
+ matrix T such that T D T−1 is diagonal the fourth order derivative cross-coupling terms are eliminated. However, in general,
1348
+ this also renders the resulting mobility matrix T �
1349
+ M T−1 nondiagonal. In contrast, if the mobility matrix is constant, i.e.,
1350
+ M = M0, it can be moved behind the second spatial derivative. Then, one can pick a matrix T that diagonalises the product
1351
+ M0 D and eliminate the fourth order spatial derivative cross-coupling within the potentials without re-introducing it through
1352
+ dynamic cross-coupling terms.
1353
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
1354
+
1355
+ 14
1356
+ Quantities in
1357
+ Eq. (13)
1358
+ Q0 = Q(u0)
1359
+ Q1 =
1360
+
1361
+ i
1362
+ ∂Q
1363
+ ∂ui
1364
+ ����
1365
+ u0
1366
+ (u1)i
1367
+ Q2 = 1
1368
+ 2
1369
+
1370
+ i,j
1371
+ ∂2Q
1372
+ ∂ui∂uj
1373
+ ����
1374
+ u0
1375
+ (u1)i (u1)j +
1376
+
1377
+ i
1378
+ ∂Q
1379
+ ∂ui
1380
+ ����
1381
+ u0
1382
+ (u2)i
1383
+ Rm, ηm, µm, F m for m = 0, 1, 2 analogously
1384
+ η3 = 1
1385
+ 6
1386
+
1387
+ i,j,k
1388
+ ∂3η
1389
+ ∂ui∂uj∂uk
1390
+ ����
1391
+ u0
1392
+ (u1)i (u1)j (u1)k +
1393
+
1394
+ i
1395
+ ∂η
1396
+ ∂ (∆ui)
1397
+ ����
1398
+ u0
1399
+ (∆u1)i
1400
+ +
1401
+
1402
+ i,j
1403
+ ∂2η
1404
+ ∂ui∂uj
1405
+ ����
1406
+ u0
1407
+ (u1)i (u2)j +
1408
+
1409
+ i
1410
+ ∂η
1411
+ ∂ui
1412
+ ����
1413
+ u0
1414
+ (u3)i
1415
+ µ3, F 3
1416
+ analogously
1417
+ Eq. (19)
1418
+ ηρ = ∂η
1419
+ ∂ρ
1420
+ ����
1421
+ u0
1422
+ +
1423
+
1424
+ i
1425
+ ∂η
1426
+ ∂ni
1427
+ ����
1428
+ u0
1429
+ (nρ)i
1430
+ ησ = ∂η
1431
+ ∂σ
1432
+ ����
1433
+ u0
1434
+ +
1435
+
1436
+ i
1437
+ ∂η
1438
+ ∂ni
1439
+ ����
1440
+ u0
1441
+ (nσ)i
1442
+ µρ, µσ
1443
+ analogously
1444
+ Eq. (32)
1445
+ qρ = ∂Q
1446
+ ∂ρ
1447
+ ����
1448
+ u0
1449
+ +
1450
+
1451
+ i
1452
+ ∂Q
1453
+ ∂ni
1454
+ ����
1455
+ u0
1456
+ (nρ)i
1457
+ qσ = ∂Q
1458
+ ∂σ
1459
+ ����
1460
+ u0
1461
+ +
1462
+
1463
+ i
1464
+ ∂Q
1465
+ ∂ni
1466
+ ����
1467
+ u0
1468
+ (nσ)i
1469
+ rρ, rσ
1470
+ analogously
1471
+ ηρρ =1
1472
+ 2
1473
+ ∂2η
1474
+ ∂ρ2
1475
+ ����
1476
+ u0
1477
+ +
1478
+
1479
+ i
1480
+ ∂2η
1481
+ ∂ρ∂ni
1482
+ ����
1483
+ u0
1484
+ (nρ)i + 1
1485
+ 2
1486
+
1487
+ i,j
1488
+ ∂2η
1489
+ ∂ni∂nj
1490
+ ����
1491
+ u0
1492
+ (nρ)i (nρ)j
1493
+ ηρσ = ∂2η
1494
+ ∂ρ∂σ
1495
+ ����
1496
+ u0
1497
+ +
1498
+
1499
+ i
1500
+ ∂2η
1501
+ ∂ρ∂ni
1502
+ ����
1503
+ u0
1504
+ (nσ)i +
1505
+
1506
+ i
1507
+ ∂2η
1508
+ ∂σ∂ni
1509
+ ����
1510
+ u0
1511
+ (nρ)i +
1512
+
1513
+ i,j
1514
+ ∂2η
1515
+ ∂ni∂nj
1516
+ ����
1517
+ u0
1518
+ (nρ)i (nσ)j
1519
+ ησσ =1
1520
+ 2
1521
+ ∂2η
1522
+ ∂σ2
1523
+ ����
1524
+ u0
1525
+ +
1526
+
1527
+ i
1528
+ ∂2η
1529
+ ∂σ∂ni
1530
+ ����
1531
+ u0
1532
+ (nσ)i + 1
1533
+ 2
1534
+
1535
+ i,j
1536
+ ∂2η
1537
+ ∂ni∂nj
1538
+ ����
1539
+ u0
1540
+ (nσ)i (nσ)j
1541
+ µρρ, µρσ, µσσ
1542
+ analogously
1543
+ Eq. (34)
1544
+ qρρ =1
1545
+ 2
1546
+ ∂2Q
1547
+ ∂ρ2
1548
+ ����
1549
+ u0
1550
+ +
1551
+
1552
+ i
1553
+ ∂2Q
1554
+ ∂ρ∂ni
1555
+ ����
1556
+ u0
1557
+ (nρ)i + 1
1558
+ 2
1559
+
1560
+ i,j
1561
+ ∂2Q
1562
+ ∂ni∂nj
1563
+ ����
1564
+ u0
1565
+ (nρ)i (nρ)j
1566
+ qρσ, qσσ, rρρ, rρσ, rσσ
1567
+ analogously
1568
+ ηρρρ =1
1569
+ 6
1570
+ ∂3η
1571
+ ∂ρ3
1572
+ ����
1573
+ u0
1574
+ + 1
1575
+ 2
1576
+
1577
+ i
1578
+ ∂3η
1579
+ ∂ρ2∂ni
1580
+ ����
1581
+ u0
1582
+ (nρ)i + 1
1583
+ 2
1584
+
1585
+ i,j
1586
+ ∂3η
1587
+ ∂ρ∂ni∂nj
1588
+ ����
1589
+ u0
1590
+ (nρ)i (nρ)j + 1
1591
+ 6
1592
+
1593
+ i,j,k
1594
+ ∂3η
1595
+ ∂ni∂nj∂nk
1596
+ ����
1597
+ u0
1598
+ (nρ)i (nρ)j (nρ)k
1599
+ ηρρσ =1
1600
+ 2
1601
+ ∂3η
1602
+ ∂ρ2∂σ
1603
+ ����
1604
+ u0
1605
+ + 1
1606
+ 2
1607
+
1608
+ i
1609
+ ∂3η
1610
+ ∂ρ2∂ni
1611
+ ����
1612
+ u0
1613
+ (nσ)i +
1614
+
1615
+ i
1616
+ ∂3η
1617
+ ∂ρ∂σ∂ni
1618
+ ����
1619
+ u0
1620
+ (nρ)i +
1621
+
1622
+ i,j
1623
+ ∂3η
1624
+ ∂ρ∂ni∂nj
1625
+ ����
1626
+ u0
1627
+ (nρ)i (nσ)j
1628
+ + 1
1629
+ 2
1630
+
1631
+ i,j
1632
+ ∂3η
1633
+ ∂σ∂ni∂nj
1634
+ ����
1635
+ u0
1636
+ (nρ)i (nρ)j + 1
1637
+ 2
1638
+
1639
+ i,j,k
1640
+ ∂3η
1641
+ ∂ni∂nj∂nk
1642
+ ����
1643
+ u0
1644
+ (nρ)i (nρ)j (nσ)k
1645
+ ηρσσ, ησσσ, µρρρ, µρρσ, µρσσ, µσσσ
1646
+ analogously
1647
+ ηρxx =
1648
+ ∂η
1649
+ ∂ (∆ρ)
1650
+ ����
1651
+ u0
1652
+ +
1653
+
1654
+ i
1655
+ ∂η
1656
+ ∂ (∆ni)
1657
+ ����
1658
+ u0
1659
+ (nρ)i
1660
+ ησxx, µρxx, µσxx analogously
1661
+ TABLE II. Relations between the quantities in the original equation (11) and the various coefficients appearing in equations (13), (19), (32),
1662
+ and (34) at the different orders in ε.
1663
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
1664
+
1665
+ 15
1666
+ Model
1667
+ field variables
1668
+ zero coefficients
1669
+ nonzero coefficients
1670
+ You et al. [56] and Frohoff-H¨ulsmann et al. [16]
1671
+ ∂tφµ = ∆
1672
+
1673
+ −γµ∆φµ + χµφµ + 1
1674
+ 3φ3
1675
+ µ + κµνφν
1676
+
1677
+ with
1678
+ 1
1679
+ |V |
1680
+
1681
+ V dV φµ = ¯φ0
1682
+ µ
1683
+ µ = A, B , ν ̸= µ
1684
+ ϱ = φA − φ0
1685
+ A
1686
+ ς = φB − φ0
1687
+ B
1688
+ ηρσ, ησσ
1689
+ µρρ, µρσ
1690
+ ηρρσ, ηρσσ, ησσσ
1691
+ µρρρ, µρρσ , µρσσ
1692
+ ησxx
1693
+ µρxx
1694
+ ηρ = χA +
1695
+
1696
+ φ0
1697
+ A
1698
+ �2
1699
+ µσ = χB +
1700
+
1701
+ φ0
1702
+ B
1703
+ �2
1704
+ ησ = κAB
1705
+ µρ = κBA
1706
+ ηρρ = φ0
1707
+ A
1708
+ µσσ = φ0
1709
+ B
1710
+ ηρρρ = µσσσ = 1
1711
+ 3
1712
+ ηρxx = −γA
1713
+ µσxx = −γB
1714
+ Saha et al. [47]
1715
+ ∂tφ1 = ∆
1716
+
1717
+ − κ∆φ1 + 2(c1,1 + c1,2)2φ1 − 6(c1,1 + c1,2)φ2
1718
+ 1
1719
+ +4φ3
1720
+ 1 + (χ + α)φ2 + 2χ′φ1φ2
1721
+ 2
1722
+
1723
+ ∂tφ2 = ∆
1724
+
1725
+ − κ∆φ2 + 2(c2,1 + c2,2)2φ2 − 6(c2,1 + c2,2)φ2
1726
+ 2
1727
+ +4φ3
1728
+ 2 + (χ − α)φ1 + 2χ′φ2φ2
1729
+ 1
1730
+
1731
+ with
1732
+ 1
1733
+ |V |
1734
+
1735
+ V dV φi = ¯φi
1736
+ i = 1, 2
1737
+ ϱ = φ1 − ¯φ1
1738
+ ς = φ2 − ¯φ2
1739
+ ηρρσ, ησσσ
1740
+ µρρρ, µρσσ
1741
+ ησxx
1742
+ µρxx
1743
+ ηρ = 2(c1,1 + c1,2)2 + 12¯φ2
1744
+ 1 + 2χ′ ¯φ2
1745
+ 2
1746
+ µσ = 2(c2,1 + c2,2)2 + 12¯φ2
1747
+ 2 + 2χ′ ¯φ2
1748
+ 1
1749
+ ησ = χ + α + 4χ′ ¯φ1 ¯φ2
1750
+ µρ = χ − α + 4χ′ ¯φ1 ¯φ2
1751
+ ηρρ = −6(c1,1 + c1,2) + 12¯φ1
1752
+ µσσ = −6(c2,1 + c2,2) + 12¯φ2
1753
+ ησσ = 2χ′ ¯φ1
1754
+ ηρσ = 4χ′ ¯φ2
1755
+ µρρ = 2χ′ ¯φ2
1756
+ µρσ = 4χ′ ¯φ1
1757
+ ηρσσ = µρρσ = 2χ′
1758
+ ηρρρ = µσσσ = 4
1759
+ ηρxx = µσxx = −κ
1760
+ Zimmermann [57]
1761
+ ∂tA = −G∆
1762
+
1763
+ ε + (1 + ib)∆ − (1 + ic)|A|2�
1764
+ A
1765
+ with A = Ar + iAi
1766
+ ϱ = Ar
1767
+ ς = Ai
1768
+ ησ, µρ
1769
+ ηρρ, ηρσ, ησσ
1770
+ µρρ, µρσ, µσσ
1771
+ ηρ = µσ = −Gε
1772
+ ηρσσ = ηρρρ = µρρσ = µσσσ = G
1773
+ µρσσ = µρρρ = −ηρρσ = −ησσσ = −Gc
1774
+ ησxx = −µρxx = Gb
1775
+ ηρxx = µσxx = −G
1776
+ Reciprocal Cahn-Hilliard [variational structure]
1777
+ ∂φi = ∆ δF
1778
+ δφi
1779
+ with F = �
1780
+ i Fi + Fcoup
1781
+ Fi = �
1782
+ i
1783
+
1784
+ dV
1785
+
1786
+ κi
1787
+ 2 (∇φi)2 + αi
1788
+ 2 φ2
1789
+ i + βi
1790
+ 3 φ3
1791
+ i + γi
1792
+ 4 φ4
1793
+ i
1794
+
1795
+ Fcoup =
1796
+
1797
+ dV
1798
+
1799
+ K∇φ1∇φ2 + aφ1φ2 + b1φ2
1800
+ 1φ2 + b2φ1φ2
1801
+ 2
1802
+ +c1φ3
1803
+ 1φ2 + c2φ2
1804
+ 1φ2
1805
+ 2 + c3φ1φ3
1806
+ 2
1807
+
1808
+ 1
1809
+ |V |
1810
+
1811
+ V dV φi = 0
1812
+ ϱ = φ1
1813
+ ς = φ2
1814
+
1815
+ ηρ = α1
1816
+ µσ = α2
1817
+ ηρρ = β1
1818
+ µσσ = β2
1819
+ ηρρρ = γ1
1820
+ µσσσ = γ2
1821
+ ηρxx = −κ1
1822
+ µσxx = −κ2
1823
+ ησ = µρ = a
1824
+ ησxx = µρxx = −K
1825
+ ηρσ = 2µρρ = 2b1
1826
+ 2ησσ = µρσ = 2b2
1827
+ ηρρσ = 3µρρρ = 3c1
1828
+ ηρσσ = µρρσ = 2c2
1829
+ 3ησσσ = µρσσ = 3c3
1830
+ TABLE III. Identification of models studied in the literature [16, 47, 56, 57] as special cases of the here derived general nonreciprocal Cahn-
1831
+ Hilliard model in the form of Eqs. (37). All literature models consider constant mobilities, i.e., Q = R = 1. Furthermore the relation to the
1832
+ reciprocal limit case is given.
1833
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
1834
+
1835
+ 16
1836
+ 0
1837
+ km
1838
+ k +
1839
+ k
1840
+ 0
1841
+ ∆m
1842
+ ∆, Ω
1843
+ ∼ ε
1844
+ ∼ ε4
1845
+ FIG. 3. Dispersion relations (43) below (blue lines), at (purple line) and above (red line) the threshold of a codimension-2 Cahn-Hilliard
1846
+ instability where two Cahn-Hilliard modes become simultaneously unstable. Labeled dotted lines and solid bars indicate typical quantities and
1847
+ scalings above onset.
1848
+ 3.
1849
+ Amplitude equation for codimension-2 Cahn-Hilliard instability
1850
+ Up to here we have considered the conserved-Hopf instability as one basic codimension-1 bifurcation and have derived the
1851
+ nonreciprocal Cahn-Hilliard equations as the corresponding generic amplitude equation. Next, we furthermore show that it also
1852
+ corresponds to the amplitude equation of another (codimension-2) instability that involves two conservation laws. In particular,
1853
+ we consider the dispersion relation characterized by two real eigenvalues given by
1854
+ λ±(k) = δ±k2 − ˜δ±k4 + O(k6) .
1855
+ (43)
1856
+ Considering the codimension-2 instability where both real modes simultaneously become unstable at control parameter ε = 0,
1857
+ both leading order growth rates are small, i.e., δ± = δ±,2ε2. Fig. 3 illustrates the dispersion relations below, at and above the
1858
+ onset. The indicated scalings of the band of unstable wavenumbers and of the maximal growth rate are as in Fig. 1 of the main
1859
+ text.
1860
+ Again we consider the general multi-component model (11), naively use the same ansatz (12) and only discuss the differences
1861
+ for the current case as compared to the analysis done in Section 2 of the Supplementary Material. First, all terms at order ε and
1862
+ ε2 are unchanged. We also find the same linear system (20) at order ε3. However, in contrast to the previously treated case of
1863
+ the conserved-Hopf instability, the resulting eigenvalues are real, i.e., the inequality (24) is reversed and we identify
1864
+ Q0ηρ + R0µσ
1865
+ 2
1866
+ ±
1867
+
1868
+ (Q0ηρ − R0µσ)2
1869
+ 4
1870
+ + Q0ησR0µρ = δ± .
1871
+ (44)
1872
+ Now we demand that both δ+ and δ− are O(ε2) and, thus, we can set them to zero at this order. In consequence, there is no
1873
+ dynamics on timescale τ which is as expected since there is no oscillation in contrast to the conserved-Hopf case. In other
1874
+ words, while for the case of a conserved-Hopf instability the leading order frequency is ωk2 with ω = O(1), here ω is O(ε2)
1875
+ and imaginary, i.e., is simply part of the growth rate.
1876
+ Proceeding to orders ε4 and ε5, equations (31)-(34) are recovered and using the same recombination as in Eq. (35), again
1877
+ we obtain amplitude equations that correspond to the generalized nonreciprocal Cahn-Hilliard model (37). Linearization yields
1878
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
1879
+
1880
+ 17
1881
+ Eq. (39), and calculating the eigenvalues, again we recover the original dispersion relation, i.e., we identify
1882
+ Q0ηρxx + R0µσxx
1883
+ 2
1884
+ ± ηρηρxxQ2
1885
+ 0 + (2ησxxµρ + 2ησµρxx − ηρxxµσ − ηρµσxx)Q0R0 + µσµσxxR2
1886
+ 0
1887
+ 2
1888
+
1889
+ η2ρQ2
1890
+ 0 − 2ηρµσQ0R0 + R0(4ησµρQ0 + µ2σR0)
1891
+ = −˜δ± .
1892
+ (45)
1893
+ We conclude that beside the conserved-Hopf instability the generalized nonreciprocal Cahn-Hilliard model also describes the
1894
+ generic behavior close to the simultaneous onset of two large-scale stationary instabilities with conservation laws, i.e., two Cahn-
1895
+ Hilliard instabilities. It is valid when the inequality (24) is reversed, i.e., when the imaginary part of the eigenvalues vanish, and
1896
+ the resulting additional contributions to the growth rates are still small, i.e., O(ε2).
1897
+ Note that, in general, there are no further emerging conditions on the coefficients of the nonlinear terms in Eq. (37), i.e.,
1898
+ despite the stationary character of the considered codimension-2 instability, the resulting amplitude equations are normally still
1899
+ nonreciprocal, i.e., nonvariational, if the original model is nonvariational. In practice, this implies that nonlinear states resulting
1900
+ from secondary, tertiary, etc. instabilities may exhibit time-dependent (periodic or irregular) behavior. In contrast, if the original
1901
+ model is variational itself the resulting amplitude equations will directly inherit the variational structure and the parameters of the
1902
+ nonreciprocal Cahn-Hilliard model aquire mutual relations that renders it a reciprocal Cahn-Hilliard model. The corresponding
1903
+ conditions for the various parameters are given in the final row of Table III. This occurs, for instance, in the case of dewetting
1904
+ isothermal two-layer liquid films on solid substrates [24, 42] and decomposing ternary mixtures [31, 32].
1905
+ Preprint– contact: u.thiele@uni-muenster.de – www.uwethiele.de – January 16, 2023
1906
+
J9E5T4oBgHgl3EQfXw8r/content/tmp_files/load_file.txt ADDED
The diff for this file is too large to render. See raw diff
 
K9E2T4oBgHgl3EQfVQcE/content/2301.03820v1.pdf ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:8433f798b33c690163a9bdea349b5b4996cefd539d3e3e29d4f8d24b6e87f6b1
3
+ size 488462
K9E2T4oBgHgl3EQfVQcE/vector_store/index.faiss ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:d6d8b3f4646c2c41b1a00ead46ea1a954762fa0288f70cc4e867c7c47c10800e
3
+ size 1376301
K9E2T4oBgHgl3EQfVQcE/vector_store/index.pkl ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:c3161c34dbf8b03c58ae981299bc79f6eea4de1514323a74a13e163f0009a581
3
+ size 57383
K9FRT4oBgHgl3EQf1Th-/content/2301.13656v1.pdf ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:b368f2395186db7e5ed9f72120e3a0111e3ec7b274c094827da19aeac1911d15
3
+ size 17461058
K9FRT4oBgHgl3EQfEDfx/content/2301.13475v1.pdf ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:23c390176692f4c2ba851563b993533dc1f34a995c55db2e586481bde5a8cf3b
3
+ size 335637
K9FRT4oBgHgl3EQfEDfx/vector_store/index.faiss ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:3be7c34871662c1015ee441dc38685ea3b2140638ba7f9830ccb3e586874eaf6
3
+ size 1572909
K9FRT4oBgHgl3EQfEDfx/vector_store/index.pkl ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:d964ce47ea26e8be636bef313f25e03f381545247dd3a68e558593031539f9eb
3
+ size 65805
KtAyT4oBgHgl3EQfTvdX/content/tmp_files/2301.00111v1.pdf.txt ADDED
@@ -0,0 +1,551 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Random bit generation based on self-chaotic microlasers
2
+ with enhanced chaotic bandwidth
3
+ JIAN-CHENG LI,1,2JIN-LONG XIAO,1,2 YUE-DE YANG,1,2 AND YONG-ZHEN HUANG1,2, *
4
+ 1State Key Laboratory of Integrated Optoelectronics, Institute of Semiconductors, Chinese Academy of Sciences, Beijing 100083,
5
+ China
6
+ 2Center of Material Science and Optoelectronic Technology, University of Chinese Academy of Sciences, Beijing 100049, China
7
+ *Corresponding author Email: yzhuang@semi.ac.cn
8
+ Abstract: Chaotic semiconductor lasers have been widely investigated for high-speed random bit generation, which
9
+ is applied for the generation of cryptographic keys for classical and quantum cryptography systems. Here, we propose
10
+ and demonstrate a self-chaotic microlaser with enhanced chaotic bandwidth for high-speed random bit generation. By
11
+ designing tri-mode interaction in a deformed square microcavity laser, we realize a self-chaotic laser caused by two-
12
+ mode internal interaction, and achieve an enhanced chaotic standard bandwidth due to the photon-photon resonance
13
+ effect by introducing the third mode. Moreover, 500 Gb/s random bit generation is realized and the randomness is
14
+ verified by the NIST SP 800-22 statistics test. Our demonstration promises the applications of microlasers in secure
15
+ communication, chaos radar, and optical reservoir computing, and also provides a platform for the investigations of
16
+ multimode nonlinear laser dynamics.
17
+
18
+ 1. Introduction
19
+ Physical random bits play an important role in cryptography systems, information security, stochastic modeling, and
20
+ Monte Carlo simulation [1–4]. Physical random bit generation (RBG) was achieved with low generation rates (at Mb/s
21
+ level) based on thermal noise [5] and sampling phase jitter [6] in specific circuits, stochastic threshold switching in
22
+ memristors [7], and quantum vacuum state fluctuations [8]. To realize high-speed RBG, chaotic semiconductor lasers
23
+ as favorable physical entropy sources have been widely investigated owing to their large bandwidth and intensive
24
+ randomness [9–14]. However, semiconductor lasers, governed by the two parameters of mode intensity and carrier
25
+ inversion, usually need external perturbations to generate specific nonlinear dynamic states, such as periodic
26
+ oscillations and chaos [15]. Consequently, chaotic semiconductor lasers were investigated under external optical
27
+ feedback [9, 10, 16–18] and optical injection [14, 19, 20]. To simplify the system complexity, integrated chaos lasers
28
+ were developed with a passive feedback cavity [12, 21–23], optoelectronic feedback [24], or mutual injection lasers
29
+ [25, 26]. In addition, deterministic polarization chaos, caused by nonlinear mode competition including carrier spin
30
+ relaxation, was realized for a free-running quantum dot vertical-cavity surface-emitting laser [27]. Recently, parallel
31
+ ultrafast RBG was demonstrated in a broad area semiconductor laser with curved facets, using spatiotemporal
32
+ interference of many lasing modes with unpredictable spontaneous noise [28]. A self-chaotic microcavity laser was
33
+ demonstrated by using two-mode internal interaction, and 10 Gb/s RBG was obtained from the chaotic laser output
34
+ [29]. However, chaotic semiconductor lasers under delayed optical feedback or mutual coupling have obvious
35
+ correlation peaks of the time delay signature [9, 13], which reduces the randomness and security in random number
36
+ generation. The ultrafast RBG relying on many modes requires a large broad area cavity under large-current pulse
37
+ operation [28], and the chaotic bandwidth and RBG rate were limited by the laser relaxation oscillation frequency
38
+ [29].
39
+ In this paper, we propose and demonstrate a tri-mode self-chaotic microlaser with an enhanced chaotic bandwidth
40
+ by employing the photon-photon resonance effect [30]. By designing a deformed square microcavity with circular
41
+ sides, we can enhance the mode Q-factors and engineer the mode frequency interval [31]. Since passive mode Q-
42
+ factors are larger than 104 for the fundamental (0th), first (1st) and second-order (2nd) transverse modes, they can all
43
+ approach the threshold condition for an AlGaInAs/InP deformed square microlaser, with a Q-factor determined by
44
+ absorption loss much lower than 104. As shown in Fig. 1(a), the self-chaotic microlaser is realized by the mode
45
+ interaction between the 0th and 1st order transverse modes, and the chaotic bandwidth is enhanced due to photon-
46
+ photon resonance caused by mode beating with the 2nd order transverse mode. The mode intensity patterns of the 0th
47
+ and 1st transverse modes are shown in the insets of Fig. 1(c), their field distributions are in-phase and anti-phase in
48
+ half a region, respectively, which is clearer than those in the deformed hexagonal microcavity [29]. The enhancement
49
+ and cancellation of mode beating intensities result in strong differences of carrier consumption in the in-phase and
50
+ anti-phase regions, which transfer at the mode beating frequency. As the beating frequency approaches the relaxation
51
+
52
+ oscillation frequency, the mode beating intensity will cause strong carrier oscillation and the appearance of mode side
53
+ peaks similar to that under external modulation, which results in strong internal mode interaction and self-chaos [29].
54
+ The further mode beating with the 2nd order transverse mode will induce additional high-frequency peaks in the
55
+ response curve as shown in Fig. 1(a), i.e., the chaotic bandwidth enhanced by the photon-photon resonance effect for
56
+ directly modulated lasers [30]. Based on the novel method, we demonstrate a tri-mode self-chaos deformed square
57
+ microcavity laser with 33.9 GHz chaos bandwidth, and realize 500 Gb/s RBG from the chaotic microlaser output.
58
+
59
+
60
+
61
+ Fig. 1. (a) Schematic diagram of self-chaos due to two-mode interaction and chaotic bandwidth enhanced by photon-photon resonance of the mode
62
+ beating with the third mode. Carrier oscillation at the beating frequency of the 0th and 1st transverse modes 0 and 1 causes side peaks for the lasing
63
+ modes, which work as the internal optical injection terms and cause self-chaos. The chaotic bandwidth is extended to the high-frequency region
64
+ due to the photon-photon resonance with the 2nd transverse mode 2. (b) Three-dimensional schematic diagram and two-dimensional top-view of a
65
+ circular-sided square microcavity laser with a central hole and a ring electrode corresponding to a refractive index step Δn. (c) Mode Q-factor versus
66
+ mode wavelength. Insets are mode intensity distributions of the 0th, 1st and 2nd transverse modes. (d)Transverse mode intervals Δf01 and Δf12 and (e)
67
+ degenerated mode intervals Δf00 and Δf11 versus Δn.
68
+ 2. Self-chaos generation
69
+ A three-dimensional schematic diagram and two-dimensional top-view of the deformed square microcavity laser are
70
+ shown in Fig. 1(b), where a central hole is applied to further control the transverse mode number. The transverse
71
+ electric (TE) mode characteristics are numerically investigated using a two-dimensional finite element method, for a
72
+ deformed square with the flat-side length a = 20 µm, circular-side deformation parameter δ = 2.17 µm, the width of
73
+ output waveguide d = 1.5 µm, the shift of the output waveguide h = 4√2 µm, and the radius of the central hole Rin =
74
+ 5.5 µm. Two degenerated modes with nearly the same magnitude of Q-factors and mode field patterns are obtained
75
+
76
+ (a)
77
+ V
78
+ (b) BCB,layer
79
+ Ohmic contact window10
80
+ 1547
81
+ 1548
82
+ 1549
83
+ 1550
84
+ 1551
85
+ 1552
86
+ 1553
87
+ Ix1.
88
+ 041(d)30
89
+ e)0.0F
90
+ oo1o1o20J00
91
+ 10
92
+ Z
93
+ Af113(468101214
94
+ +
95
+ △n (x0.001)
96
+ An (x0.001)AA.interaction
97
+ AlGalnAs
98
+ InP substrate
99
+ Quantum wellspf
100
+ High-frequency oscillation
101
+ Photon-photon
102
+ resonanceChaos Bandwidth enhancement
103
+ M
104
+ 106S1Ω-factol
105
+ 0103for each transverse mode. We give the results for the degenerated mode with a higher Q-factor in the following. As
106
+ shown in Fig. 1(c), the simulated mode Q-factors are 4.1 × 105, 6.9 × 104, and 1.7 × 104 for the 0th, 1st and 2nd order
107
+ transverse modes, respectively, with mode wavelengths of 1550.093, 1550.160, and 1550.265 nm. The corresponding
108
+ squared magnetic field distributions are shown in the insets of Fig. 1(c). In addition, a ring p-electrode with a width
109
+ of 4 µm is designed for fine adjustment of the mode frequency interval, with a refractive index step ∆n to simply
110
+ account for carrier and temperature distributions inside the resonator [32]. The calculated mode frequency intervals
111
+ Δf01 = f0th - f1st and Δf12 = f1st – f2nd and degenerate mode intervals Δf00 and Δf11 versus Δn are plotted in Figs. 1(d) and
112
+ 1(e), respectively. The magnitude of Δf01 around 10 GHz is suitable for realizing a chaotic microlaser caused by
113
+ internal mode interaction [29]. In the range 0.003 < Δn < 0. 008, complex mode coupling results in a large splitting
114
+ for Δf11.
115
+
116
+
117
+
118
+ Fig. 2. (a) Schematic of the experimental setup for the test of nonlinear dynamic states. ISO, isolator; OSA, optical spectrum analyzer; EDFA,
119
+ erbium-doped fiber amplifier; OBPF, optical bandpass filter; PD, photodetector; ESA, electrical spectrum analyzer; OSC, real-time oscilloscope.
120
+ (b) Laser power and applied voltage versus injected current. Insets: SEM image of a deformed square microcavity and lasing spectra map with
121
+ respect to current. (c) Lasing spectra and (d) corresponding electric power spectra of steady, periodic, and chaotic states at 5.6, 6.6 and 8.8 mA,
122
+ respectively.
123
+ According to the designed microcavity parameters, circular-sided square microcavity lasers were realized using
124
+ an AlGaInAs/InP compressively-strained multiple quantum well laser wafer with the same manufacturing process as
125
+ in [29]. The microlasers were tested at a heat sink temperature of 289 K using the experimental setup shown in Fig.
126
+ 2(a). The output power coupled into a tapered single-mode fiber (SMF) and the applied voltage versus continuous-
127
+ wave injection current are plotted in Fig. 2(b), where the insets are the scanning electron microscope image of an
128
+ etched microcavity and the lasing spectra from 4 to 40 mA. A threshold current of 4 mA is estimated based on lasing
129
+ spectra. Nonlinear dynamics of the laser output were investigated, including lasing spectra, radio-frequency (RF)
130
+ spectra, and time domain signal. As shown in Fig. 2(c), three peaks at 1539.384, 1539.560 and 1539.876 nm are
131
+ observed at an injection current of 5.6 mA, with mode frequency intervals of 22 and 39.5 GHz. Comparing the
132
+ simulated results in Fig. 1(c), these peaks are identified as the 0th, 1st and 2nd transverse modes, respectively. The
133
+ corresponding RF spectrum is shown in Fig. 2(d), which almost coincident with noise floor at 5.6 mA. By increasing
134
+ the current to 6.6 mA, side peaks with an interval of ~0.04 nm (~5 GHz) are observed for the main lasing peaks, which
135
+ may be attributed to the mode beating between the degenerate modes of the 1st transverse mode as indicated by the
136
+ simulated results in Fig. 1(e). A sharp harmonic peak at 5 GHz appears in the corresponding RF spectrum in Fig. 2(d)
137
+ at 6.6 mA. At 8.8 mA, a broadened lasing spectrum appears due to strong mode interaction, similar as the chaotic
138
+
139
+ (c)
140
+ (a)
141
+ 5.6 mA
142
+ 6.6 mA
143
+ 8.8 mA
144
+ OSA
145
+ OSC
146
+ -40
147
+ 1 st
148
+ (dBm)
149
+
150
+ Microcavity laser
151
+ -50
152
+
153
+ ISO
154
+ ESA
155
+ othInten
156
+ M
157
+ PD
158
+ -70
159
+ OBPF
160
+ Bias-T
161
+ 00
162
+ 2nd
163
+ -80
164
+ 1539.5
165
+ 1540.0 1539.5
166
+ 1540.0 1539.5
167
+ 1540.0
168
+ 2.5
169
+ (b)
170
+ Wavelength (nm)2.0
171
+ noise floor
172
+ 20
173
+ 5.6 mA
174
+ (Mn)
175
+ 6.6 mA
176
+ 80
177
+ 8.8 mA
178
+ Intensity
179
+ ower
180
+ (dBm)
181
+ 1.0P
182
+ -40
183
+ Inten
184
+ 320
185
+ Curr
186
+ -60-
187
+ 0.5
188
+ 5
189
+ 10
190
+ -100
191
+ 80
192
+ 1540
193
+ 1550
194
+ 1560
195
+ Wavel
196
+ ngth(nm)
197
+ 0.0
198
+ 10
199
+ 20
200
+ 30
201
+ 40
202
+ 50
203
+ 0
204
+ 0
205
+ 5
206
+ 10
207
+ 15
208
+ Current (mA)
209
+ Frequency (GHz)lasing spectrum in [29], which is mainly caused by the mode interaction between the 0th and 1st modes. The chaotic
210
+ standard bandwidth, which covers 80% of the total RF power [33], is calculated to be 9.6 GHz at 8.8 mA.
211
+ 3. Chaotic bandwidth enhancement
212
+ The enhancement of chaotic bandwidth due to photon-photon resonance is demonstrated in Fig. 3. Here, the main
213
+ lasing modes jump to around 1550.5 nm with even high injection currents due to the current heating effect. As shown
214
+ in Figs. 3(a) and 3(b), a long-wavelength mode assigned as the 2nd mode increases much faster than other lasing peaks
215
+ with the current and becomes the main lasing mode at 20 mA, and the high frequency peaks at around 21 and 32 GHz
216
+ of the RF spectra are greatly enhanced. The calculated chaos standard bandwidths are 13.7, 28.2, and 33.9 GHz at 16,
217
+ 18, and 20 mA, respectively. To clearly verify the effect of photon-photon resonance, we measured RF spectra for
218
+ filtered optical spectra as shown in Figs. 3(c) and 3(d). The RF spectra have small chaos standard bandwidths of 13.2
219
+ GHz and 8.1 GHz for the filtered optical spectra with the 0th plus 1st modes (0th + 1st) and 2nd mode, respectively. In
220
+ Fig. 3(c), the intervals between the 2nd mode peak and three evident peaks of the wide chaotic spectra are 0.184, 0.272,
221
+ and 0.320 nm, which contribute to three beating peaks at 22.8, 33.3, and 39.5 GHz for the RF spectrum in Fig. 3(d).
222
+ These results imply the origin of bandwidth enhancement due to mode beating with the 2nd mode. The AC waveform
223
+ of the chaotic laser output at 20 mA is plotted in Fig. 3(e), and the calculated autocorrelation function (ACF) is shown
224
+ in Fig. 3(f), with a half width at half maximum of 0.011 ns. The ACF has some minor peaks within 0.5 ns, but without
225
+ the time-delayed correlation peak observed in optical feedback chaotic lasers [34]. The modified Grassberger-
226
+ Procaccia (G-P) algorithm is applied to quantify the complexity of the chaos signal [35, 36], and a correlation
227
+ dimension of 11.6 is obtained, which is nearly triple that in [29].
228
+
229
+
230
+
231
+ Fig. 3. (a) Lasing spectra and (b) corresponding RF spectra at 16, 18 and 20 mA. (c) Filtered lasing spectra, the arrows show different peak intervals,
232
+ and (d) corresponding RF spectra at 20 mA. (e) Irregular temporal waveform and (f) corresponding autocorrelation function for the chaotic output
233
+ at 20 mA. The inset in (f) represents the entire ACF curve for 1 μs.
234
+ 4. Random bit generation
235
+ Furthermore, the self-chaotic microlaser was utilized to generate physical random numbers. The AC waveform signals
236
+ at 20 mA are collected with a 100 GSa/s sampling rate, and the intensity histogram distribution of the 500 µs long raw
237
+ data stream is illustrated in Fig. 4(a). The intensity distribution is asymmetric with an initial skewness of 0.40, which
238
+ is a typical feature of a chaotic semiconductor laser. The asymmetric distribution can result in bias in the generated
239
+ random sequence, and we adopted extra post-processing methods, including delay-subtracting and least significant
240
+ bits (LSBs) extraction, for RBG [10, 28]. Specifically, we subtract the original signal from its delayed signal to attain
241
+ a symmetric distribution. Considering the very low correlation coefficient at 0.5 ns in Fig. 3(f), we select a delay time
242
+ of 0.5 ns and plot the histogram distribution of the differential data in Fig. 4(b). The symmetry of the differential signal
243
+
244
+ 20
245
+ -30
246
+ 01QA1.701550.5
247
+ 1550.0
248
+ 1550.5
249
+ 1551.0
250
+ 412
251
+ 413
252
+ 414
253
+ 1550.0
254
+ 415
255
+ 416Navelength (nm)
256
+ Wavelength (nm)
257
+ Time (ns)-60
258
+ -60
259
+ 1.0.- noise floor
260
+ (b)
261
+ noise rioor16 mA
262
+ ond
263
+ 0.86 mA
264
+ a18 mA
265
+ -70
266
+ -70
267
+ 0.6A
268
+ Oth+1 st+2nde200
269
+ 400
270
+ 600
271
+ 800
272
+ 10008 mA10
273
+ AO7
274
+ oc
275
+ 20
276
+ 30
277
+ 0
278
+ 0.0
279
+ 0.4
280
+ 0.6
281
+ 0.8
282
+ L.0Freouer
283
+ Time (ns)20mA沁北is significantly improved with a skewness coefficient of 0.02. Then, the differential intensity is digitalized into 8-bit
284
+ binary numbers, and the LSBs method is adopted to destroy the residual correlations of adjacent bits and improve the
285
+ uniformity of the bit distributions. By retaining five LSBs, we can obtain a nearly uniform probability distribution, as
286
+ shown in Fig. 4(c). At the same time, the autocorrelation coefficient of the bit stream is less than 10-3 and remains at
287
+ the background level for any bit stream length in Fig. 4(d), indicating the removal of correlation between successive
288
+ bits.
289
+
290
+
291
+
292
+ Fig. 4. Histogram distribution for (a) raw signal intensity and (b) differential intensity after delay-subtracting post-processing. (c) Probability
293
+ distribution with 5-LSBs extraction, and (d) corresponding ACF curve of the bit stream.
294
+
295
+ Finally, the randomness of the generated random bits is verified using the NIST Special Publication 800-22
296
+ statistical tests, by dividing 1-Gbit data into 1000 sequences of 1-Mbit [37]. When the significance level is set to 0.01,
297
+ the randomness test is successful if the P-value is larger than 0.0001 and the proportion is within 0.99 ± 0.0094392.
298
+ For the test items that produce multiple P-values and proportions, the worst case is selected and shown in Table 1, and
299
+ the generated random bits successfully pass the 15 NIST sub-tests. The obtained maximum electrical-delay self-
300
+ difference RBG rate is 500 Gb/s (100 GSa/s×5 bits).
301
+ We also conducted an optical-delay self-difference experiment for random bit generation via balanced-detection
302
+ method in [38]. As shown in Fig. 5, the chaotic light from the microcavity laser at 20 mA is firstly amplified and
303
+ filtered. Then, the light is split into two paths after a 50:50 fiber coupler (FC). Delayed fiber (DL) with the length of
304
+ 1 m (corresponding to 5 ns optical delay) is introduced into one of the two paths. The two beams are simultaneously
305
+ detected by a balanced detector (Finisar BPD V2120R, 43 GHz bandwidth). Then the converted electrical signal is
306
+ collected by the real-time oscilloscope at 100 GSa/s sampling rate. Finally, a least-significant-bits method is adopted
307
+ and 5-LSBs are selected to generate 500 Gb/s physical random number sequence. Similarly, 1000 sequences of 1-
308
+ Mbit stream are set to the NIST SP 800-22 randomness test. All sub-tests are successful and shown in Table 1.
309
+
310
+
311
+
312
+ Fig. 5. Experimental setup for optical-delay self-difference random bit generator.
313
+
314
+
315
+ X103
316
+ X10°
317
+ 12
318
+ 8robal
319
+ ocorrelati
320
+ 0
321
+ 0.0100
322
+ 0010
323
+ 20
324
+ +0
325
+ 100
326
+ Index
327
+ Bit stream length NMicrocavitylaser
328
+ OBPF
329
+ EDFA
330
+ ISO
331
+ PD
332
+ OSC
333
+ FC
334
+ 10000
335
+ DL
336
+ PD
337
+ Balanceddetector9
338
+ 6S
339
+ S20
340
+ 0
341
+ -40
342
+ -20
343
+ 0
344
+ 20
345
+ 40
346
+ -40
347
+ -20
348
+ 0
349
+ 20
350
+ 40Voltage (mV)
351
+ Voltage (mV)
352
+ n 100CB
353
+ -0-LSBs=5
354
+ 0.03u
355
+ F
356
+ 000Table 1. NIST SP 800-22 test results for random bit sequence
357
+ Statistical Test
358
+ Electrical-delay self-
359
+ difference RBG
360
+ Optical-delay self-
361
+ difference RBG
362
+ Result
363
+ P-value
364
+ Proportion
365
+ P-value
366
+ Proportion
367
+ Frequency
368
+ 0.32214
369
+ 0.985
370
+ 0.60799
371
+ 0.992
372
+ Success
373
+ Block Frequency
374
+ 0.27027
375
+ 0.989
376
+ 0.80556
377
+ 0.986
378
+ Success
379
+ Runs
380
+ 0.37701
381
+ 0.987
382
+ 0.16080
383
+ 0.989
384
+ Success
385
+ Longest Run
386
+ 0.29109
387
+ 0.989
388
+ 0.14532
389
+ 0.986
390
+ Success
391
+ Rank
392
+ 0.62255
393
+ 0.983
394
+ 0.44655
395
+ 0.992
396
+ Success
397
+ FFT
398
+ 0.40296
399
+ 0.987
400
+ 0.14781
401
+ 0.988
402
+ Success
403
+ Nonoverlaping template
404
+ 0.00798
405
+ 0.989
406
+ 0.00487
407
+ 0.986
408
+ Success
409
+ Overlapping template
410
+ 0.30266
411
+ 0.986
412
+ 0.30412
413
+ 0.990
414
+ Success
415
+ Universal
416
+ 0.60177
417
+ 0.987
418
+ 0.11606
419
+ 0.990
420
+ Success
421
+ Linear complexity
422
+ 0.23927
423
+ 0.989
424
+ 0.14125
425
+ 0.986
426
+ Success
427
+ Serial
428
+ 0.13650
429
+ 0.990
430
+ 0.13572
431
+ 0.991
432
+ Success
433
+ Approximate entropy
434
+ 0.01395
435
+ 0.993
436
+ 0.99743
437
+ 0.990
438
+ Success
439
+ Cumulative sums
440
+ 0.04365
441
+ 0.986
442
+ 0.14206
443
+ 0.987
444
+ Success
445
+ Random excursions
446
+ 0.12120
447
+ 0.986
448
+ 0.01572
449
+ 0.987
450
+ Success
451
+ Random excursions variant
452
+ 0.05205
453
+ 0.986
454
+ 0.00714
455
+ 0.995
456
+ Success
457
+
458
+ 5. Conclusion
459
+ In summary, tri-transverse-mode lasing with mode intervals of around 10 to 30 GHz has been demonstrated in a
460
+ deformed square microcavity laser. The strong mode interaction between the 0th and 1st order transverse modes with
461
+ the oscillation of the local photon density distribution inside the microcavity results in self-chaotic laser output, as in
462
+ Ref. [29]. Moreover, the 2nd order transverse mode can induce additional beating peaks for the chaotic RF spectrum
463
+ and greatly enhance the chaotic signal bandwidth. Based on tri-mode chaotic output, we have realized 500 Gb/s
464
+ physical random number generation using electrical and optical delay-subtracting RBG schemes. Our work paves the
465
+ way for mode engineering to enhance the self-chaotic bandwidth for deformed microcavity lasers. A random number
466
+ generator based on the self-chaos deformed square laser can simplify the system greatly due to a small footprint and
467
+ low power consumption for the chaotic microlasers. Moreover, self-chaotic lasers have potential applications in secure
468
+ communication, chaos radar and optical reservoir computing.
469
+
470
+ References
471
+ 1.
472
+ N. Gisin, G. Ribordy, W. Tittel, and H. Zbinden, “Quantum cryptography," Rev. Mod. Phys. 74, 145-195 (2002).
473
+ 2.
474
+ S. Asmussen and P.W. Glynn, Stochastic Simulation: Algorithms and Analysis (Springer, New York, 2007).
475
+ 3.
476
+ M. Herrero-Collantes and J. C. Garcia-Escartin, “Quantum random number generators,” Rev. Mod. Phys. 89, 015004 (2017).
477
+ 4.
478
+ Y. Liu, X. Yuan, M.-H. Li, W. Zhang, Q. Zhao, J. Zhong, Y. Cao, Y.-H. Li, L.-K. Chen, H. Li, T. Peng, Y.-A. Chen, C.-Z. Peng, S.-C. Shi,
479
+ Z. Wang, L. You, X. Ma, J. Fan, Q. Zhang, and J.-W. Pan, “High-speed device-independent quantum random number generation without a
480
+ detection loophole,” Phys. Rev. Lett. 120, 010503 (2018).
481
+ 5.
482
+ C. S. Petrie and J. A. Connelly, “A noise-based ic random number generator for applications in cryptograph generator for applications in
483
+ cryptography,” IEEE Trans. Circuits Syst. I-Fundam. Theor. Appl. 47, 615-621 (2000).
484
+ 6.
485
+ B. Sunar, W. J. Martin, and D. R. Stinson, “A provably secure true random number generator with built-in tolerance to active attacks,” IEEE
486
+ Trans. Comput. 56, 109-119 (2007).
487
+ 7.
488
+ G. M. Kim, J. H. In, Y. S. Kim, H. Rhee, W. Park, H. C. Song, J. Park, and K. M. Kim, “Self-clocking fast and variation tolerant true random
489
+ number generator based on a stochastic mott memristor,” Nat. Commun. 12, 2906 (2021).
490
+ 8.
491
+ C. Gabriel, C. Wittmann, D. Sych, R. Dong, W. Mauerer, U. L. Andersen, C. Marquardt, and G. Leuchs, “A generator for unique quantum
492
+ random numbers based on vacuum states,” Nat. Photonics 4, 711-715 (2010).
493
+ 9.
494
+ Uchida, K. Amano, M. Inoue, K. Hirano, S. Naito, H. Someya, I. Oowada, T. Kurashige, M. Shiki, S. Yoshimori, K. Yoshimura, and P. Davis,
495
+ “Fast physical random bit generation with chaotic semiconductor lasers,” Nat. Photonics 2, 728-732 (2008).
496
+ 10. I. Reidler, Y. Aviad, M. Rosenbluh, and I. Kanter, “Ultrahigh-Speed Random Number Generation Based on a Chaotic Semiconductor Laser,”
497
+ Phys. Rev. Lett. 103, 024102 (2009).
498
+ 11. I. Kanter, Y. Aviad, I. Reidler, E. Cohen, and M. Rosenbluh, "An optical ultrafast random bit generator, " Nat. Photonics 4, 58-61 (2010).
499
+ 12. G. Verschaffelt, M. Khoder, and G. Van der Sande, “Random number generator based on an integrated laser with on-chip optical feedback,”
500
+ Chaos 27, 114310 (2017).
501
+
502
+ 13. S. Y. Xiang, B. Wang, Y. Wang, Y. A. Han, A. J. Wen, and Y. Hao, “2.24-Tb/s Physical Random Bit Generation with Minimal Post-Processing
503
+ Based on Chaotic Semiconductor Lasers Network,” J. Lightwave Technol. 37, 3987-3993 (2019).
504
+ 14. X.-Z. Li and S.-C. Chan, “Random bit generation using an optically injected semiconductor laser in chaos with oversampling,” Opt. Lett. 37,
505
+ 2163-2165 (2012).
506
+ 15. M. Sciamanna and K. A. Shore, “Physics and applications of laser diode chaos,” Nat. Photonics 9, 151-162 (2015).
507
+ 16. T. Mukai and K. Otsuka, “New route to optical chaos: Successive-subharmonic-oscillation cascade in a semiconductor laser coupled to an
508
+ external cavity,” Phys. Rev. Lett. 55, 1711-1714 (1985).
509
+ 17. J. Mork, J. Mark, and B. Tromborg, “Route to chaos and competition between relaxation oscillations for a semiconductor laser with optical
510
+ feedback,” Phys. Rev. Lett. 65, 1999-2002 (1990).
511
+ 18. Y. Deng, Z.-F. Fan, B.-B. Zhao, X.-G. Wang, S. Zhao, J. Wu, F. Grillot, and C. Wang, “Mid-infrared hyperchaos of interband cascade lasers,”
512
+ Light-Sci Appl 11, 7 (2022).
513
+ 19. T. B. Simpson, J. M. Liu, A. Gavrielides, V. V. Kovanis, and P. M. Alsing, “Period-doubling cascades and chaos in a semiconductor laser
514
+ with optical injection,” Phys. Rev. A 51, 4181-4185 (1995).
515
+ 20. F. Y. Lin, S. Y. Tu, C. C. Huang, and S. M. Chang, “Nonlinear dynamics of semiconductor lasers under repetitive optical pulse injection,”
516
+ IEEE J. Sel. Top. Quantum Electron 15, 604-611 (2009).
517
+ 21. A. Argyris, M. Hamacher, K. E. Chlouverakis, A. Bogris, and D. Syvridis, “Photonic integrated device for chaos applications in
518
+ communications,” Phys. Rev. Lett. 100, 194101 (2008).
519
+ 22. J. G. Wu, L. J. Zhao, Z. M. Wu, D. Lu, X. Tang, Z. Q. Zhong, and G. Q. Xia, “Direct generation of broadband chaos by a monolithic integrated
520
+ semiconductor laser chip,” Opt. Express 21, 23358-23364 (2013).
521
+ 23. S. Sunada, T. Fukushima, S. Shinohara, T. Harayama, K. Arai, and M. Adachi, “A compact chaotic laser device with a two-dimensional
522
+ external cavity structure,” Appl. Phys. Lett. 104, 241105 (2014).
523
+ 24. P. Munnelly, B. Lingnau, M. M. Karow, T. Heindel, M. Kamp, S. Höfling, K. Lüdge, C. Schneider, and S. Reitzenstein, “On-chip
524
+ optoelectronic feedback in a micropillar laser-detector assembly,” Optica 4, 303-306 (2017).
525
+ 25. L.-X. Zou, B.-W. Liu, X.-M. Lv, Y.-D. Yang, J.-L. Xiao, and Y.-Z. Huang, “Integrated semiconductor twin-microdisk laser under mutually
526
+ optical injection,” Appl. Phys. Lett. 106, 191107 (2015).
527
+ 26. S. Ohara, A. K. Dal Bosco, K. Ugajin, A. Uchida, T. Harayama, and M. Inubushi, “Dynamics-dependent synchronization in on-chip coupled
528
+ semiconductor lasers,” Phys. Rev. E 96, 032216 (2017).
529
+ 27. M. Virte, K. Panajotov, H. Thienpont, and M. Sciamanna, “Deterministic polarization chaos from a laser diode,” Nat. Photonics 7, 60-65
530
+ (2013).
531
+ 28. K. Kim, S. Bittner, Y. Zeng, S. Guazzotti, O. Hess, Q. J. Wang, and H. Cao, “Massively parallel ultrafast random bit generation with a chip-
532
+ scale laser,” Science 371, 948-952 (2021).
533
+ 29. C. G. Ma, J. L. Xiao, Z. X. Xiao, Y. D. Yang, Y. Z. Huang, “Chaotic microlasers caused by internal mode interaction for random number
534
+ generation,” Light-Sci. Appl. 11, 187 (2022).
535
+ 30. E. Heidari, H. Dalir, M. Ahmed, V. J. Sorger, and R. T. Chen, “Hexagonal transverse-coupled-cavity VCSEL redefining the high-speed lasers,”
536
+ Nanophotonics 9, 4743-4748 (2020).
537
+ 31. H. Z. Weng, Y. Z. Huang, Y. D. Yang, X. W. Ma, J. L. Xiao, and Y. Du, “Mode Q factor and lasing spectrum controls for deformed square
538
+ resonator microlasers with circular sides,” Phys. Rev. A 95, 013833 (2017).
539
+ 32. H. Long, Y.-Z. Huang, X.-W. Ma, Y.-D. Yang, J.-L. Xiao, L.-X. Zou, and B.-W. Liu, “Dual-transverse-mode microsquare lasers with tunable
540
+ wavelength interval,” Opt. Lett. 40, 3548-3551 (2015).
541
+ 33. F. Y. Lin and J. M. Liu, “Nonlinear dynamical characteristics of an optically injected semiconductor laser subject to optoelectronic feedback,”
542
+ Opt. Commun. 221, 173-180 (2003).
543
+ 34. Y.-L. Li, C.-G. Ma, J.-L. Xiao, T. Wang, J.-L. Wu, Y.-D. Yang, and Y.-Z. Huang, “Wideband chaotic tri-mode microlasers with optical
544
+ feedback,” Opt. Express 30, 2122-2130 (2022).
545
+ 35. P. Grassberger, and I. Procaccia, “Characterization of Strange Attractors,” Phys. Rev. Lett. 50, 346-349 (1983).
546
+ 36. K. Fraedrich and R. H. Wang, “Estimating the correlation dimension of an attractor from noisy and small datasets based on re-embedding,”
547
+ Phys. D 65, 373-398 (1993).
548
+ 37. NIST SP 800-22 statistical test suite, https://csrc.nist.gov/Projects/Random-Bit-Generation/Documentation-and-Software.
549
+ 38. L. Li, A. Wang, P. Li, H. Xu, L. Wang, and Y. Wang, “Random bit Generator using delayed self-difference of filtered amplified spontaneous
550
+ emission,” IEEE Photonics J. 6, 7500109 (2014).
551
+
KtAyT4oBgHgl3EQfTvdX/content/tmp_files/load_file.txt ADDED
The diff for this file is too large to render. See raw diff
 
KtE0T4oBgHgl3EQfSQDq/vector_store/index.faiss ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:7ac226f9e252eadb578d39ae14b2c0ffb85564df549896dd815897ffd99281d7
3
+ size 3211309