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pend run import, need to recover its function later (#63)
Container #43: Commit 5a25de4 pushed by floatingCatty
February 2, 2024 09:41 44s main
February 2, 2024 09:41 44s
pend run import, need to recover its function later
DeePTB tests. #197: Pull request #63 opened by floatingCatty
February 2, 2024 09:40 9h 45m 44s floatingCatty:hot_fix_run
February 2, 2024 09:40 9h 45m 44s
Mergev2 merge data nequip refactoring into main (#61)
Container #42: Commit 7377d96 pushed by QG-phy
February 2, 2024 08:11 37s main
February 2, 2024 08:11 37s
Mergev2 merge data nequip refactoring into main
DeePTB tests. #196: Pull request #61 synchronize by floatingCatty
February 2, 2024 08:02 10h 32m 6s floatingCatty:mergev2
February 2, 2024 08:02 10h 32m 6s
Mergev2 merge data nequip refactoring into main
DeePTB tests. #195: Pull request #61 synchronize by floatingCatty
February 2, 2024 07:52 10h 41m 14s floatingCatty:mergev2
February 2, 2024 07:52 10h 41m 14s
Mergev2 merge data nequip refactoring into main
DeePTB tests. #194: Pull request #61 synchronize by floatingCatty
February 2, 2024 07:37 10h 48m 58s floatingCatty:mergev2
February 2, 2024 07:37 10h 48m 58s
fix assert bug for kpoints weight summation (#60)
Build Image #19: Commit 7873b47 pushed by QG-phy
February 2, 2024 07:15 12m 30s v1.1.0
February 2, 2024 07:15 12m 30s
Mergev2 merge data nequip refactoring into main
DeePTB tests. #193: Pull request #61 opened by floatingCatty
February 2, 2024 07:14 11h 11m 9s floatingCatty:mergev2
February 2, 2024 07:14 11h 11m 9s
fix assert bug for kpoints weight summation (#60)
Container #41: Commit 7873b47 pushed by QG-phy
February 2, 2024 05:49 11m 7s main
February 2, 2024 05:49 11m 7s
fix assert bug for kpoints weight summation
DeePTB tests. #192: Pull request #60 opened by AsymmetryChou
February 2, 2024 02:34 1m 15s AsymmetryChou:ksum
February 2, 2024 02:34 1m 15s
fix k-resolved transmission calculation bug and add kpoints sampling …
Container #40: Commit e3327bc pushed by QG-phy
February 1, 2024 13:31 38s main
February 1, 2024 13:31 38s
fix k-resolved transmission calculation bug and add kpoints sampling function especially for NEGF
DeePTB tests. #191: Pull request #59 synchronize by AsymmetryChou
February 1, 2024 12:56 1m 13s ksum
February 1, 2024 12:56 1m 13s
fix k-resolved transmission calculation bug and add kpoints sampling function especially for NEGF
DeePTB tests. #190: Pull request #59 synchronize by AsymmetryChou
February 1, 2024 12:04 1m 19s ksum
February 1, 2024 12:04 1m 19s
Hartree2eV unit constant keep the same as dptb-negf (#58)
Container #39: Commit 3d6c454 pushed by QG-phy
February 1, 2024 03:17 38s main
February 1, 2024 03:17 38s
Hartree2eV unit constant keep the same as dptb-negf
DeePTB tests. #189: Pull request #58 synchronize by AsymmetryChou
January 31, 2024 06:58 1m 11s main
January 31, 2024 06:58 1m 11s
January 31, 2024 06:53 1m 19s
Hartree2eV unit constant keep the same as dptb-negf
DeePTB tests. #187: Pull request #58 opened by AsymmetryChou
January 25, 2024 08:43 1h 22m 58s main
January 25, 2024 08:43 1h 22m 58s
Create Cu_prim.vasp in the example
Build Image #18: Commit 3b1bfa1 pushed by QG-phy
December 29, 2023 07:07 13m 34s v1.0.3
December 29, 2023 07:07 13m 34s
Create Cu_prim.vasp in the example
Container #38: Commit 3b1bfa1 pushed by QG-phy
December 29, 2023 03:09 44s main
December 29, 2023 03:09 44s
NRL update (#57)
Container #37: Commit fed61a6 pushed by floatingCatty
December 29, 2023 02:02 34s main
December 29, 2023 02:02 34s
NRL update
DeePTB tests. #186: Pull request #57 opened by QG-phy
December 27, 2023 13:58 4h 19m 42s QG-phy:nrl_update
December 27, 2023 13:58 4h 19m 42s
Example to get hr (#56)
Container #36: Commit b7fe26d pushed by QG-phy
December 25, 2023 09:04 34s main
December 25, 2023 09:04 34s
Example to get hr
DeePTB tests. #185: Pull request #56 opened by QG-phy
December 25, 2023 09:00 10h 35m 32s QG-phy:example_hr
December 25, 2023 09:00 10h 35m 32s
add doc and example for TBtrans interface (#52)
Container #35: Commit 2f20f04 pushed by QG-phy
December 25, 2023 07:59 56s main
December 25, 2023 07:59 56s
[fix] fix the validation in train nnsk and dptb, pick random 1 dat se…
Container #34: Commit 6d55d31 pushed by QG-phy
December 22, 2023 09:31 20m 19s main
December 22, 2023 09:31 20m 19s
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