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support different types of atoms in the same group (#6)
Mirror to Gitee Repo #13: Commit c281bcc pushed by xuan112358
March 15, 2025 12:34 33s develop
March 15, 2025 12:34 33s
Fix a typo of decay_rate_iter
Mirror to Gitee Repo #12: Commit 32b44f7 pushed by xuan112358
March 15, 2025 07:30 15s develop
March 15, 2025 07:30 15s
add train_args "decay_rate_iter", representing the decay rate of star…
Mirror to Gitee Repo #11: Commit d687ff9 pushed by xuan112358
March 12, 2025 14:05 2m 29s develop
March 12, 2025 14:05 2m 29s
Merge pull request #4 from ErjieWu/develop
Mirror to Gitee Repo #10: Commit cc4f775 pushed by ErjieWu
March 7, 2025 07:51 14s develop
March 7, 2025 07:51 14s
update op.shape
Mirror to Gitee Repo #9: Commit f47ab35 pushed by Chentao168
March 5, 2025 08:30 2m 28s develop
March 5, 2025 08:30 2m 28s
update deepks_band_range
Mirror to Gitee Repo #8: Commit eea7f78 pushed by Chentao168
February 25, 2025 10:18 20s develop
February 25, 2025 10:18 20s
update op for multi bandgap
Mirror to Gitee Repo #7: Commit e5b375f pushed by Chentao168
February 24, 2025 08:59 18s develop
February 24, 2025 08:59 18s
update k points
Mirror to Gitee Repo #6: Commit 09ff894 pushed by Chentao168
February 19, 2025 09:04 23s develop
February 19, 2025 09:04 23s
add para deepks_band_range
Mirror to Gitee Repo #5: Commit 9c31318 pushed by Chentao168
February 18, 2025 13:53 2m 39s develop
February 18, 2025 13:53 2m 39s
change the names of *.npy files calculated by ABACUS (#3)
Mirror to Gitee Repo #4: Commit fafe5e7 pushed by xuan112358
January 26, 2025 05:39 2m 36s develop
January 26, 2025 05:39 2m 36s
Support individual INPUT/STRU/KPT paramerters setting for each group …
Mirror to Gitee Repo #3: Commit f322587 pushed by xuan112358
January 26, 2025 05:03 2m 32s develop
January 26, 2025 05:03 2m 32s
Merge pull request #1 from xuan112358/develop-H
Mirror to Gitee Repo #2: Commit 873592f pushed by xuan112358
January 16, 2025 13:45 21s develop
January 16, 2025 13:45 21s
Merge pull request #79 from JohnYan98/STRU_GEN
Mirror to Gitee Repo #1: Commit bf7175b pushed by xuan112358
January 16, 2025 07:32 21s develop
January 16, 2025 07:32 21s