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Refactor: decrease memory cost of get_s (#5979) Mirror to Gitee Repository #1157: Commit 5d97dd8 pushed by mohanchen
March 9, 2025 03:53 35s develop
develop
March 9, 2025 03:53 35s
Fix: results not stable when using CUDA AWare MPI (#5976) Mirror to Gitee Repository #1156: Commit f1bfe91 pushed by mohanchen
March 9, 2025 03:18 4m 32s develop
develop
March 9, 2025 03:18 4m 32s
Fix #5969: First copy then output in the right order in ks_pw (#5974) Mirror to Gitee Repository #1155: Commit 648501d pushed by mohanchen
March 9, 2025 03:17 41s develop
develop
March 9, 2025 03:17 41s
Some small updates for the format (#5972) Mirror to Gitee Repository #1154: Commit 2505d4f pushed by YuLiu98
March 7, 2025 11:48 31s develop
develop
March 7, 2025 11:48 31s
Refactor: in ESolver_KS_PW, calculate deband in iter_finish, not in h… Mirror to Gitee Repository #1153: Commit 4f72eb8 pushed by mohanchen
March 7, 2025 11:43 31s develop
develop
March 7, 2025 11:43 31s
Fix a LaTeX rendering issue related to RT-TDDFT parameters in online … Mirror to Gitee Repository #1152: Commit 0b77de9 pushed by mohanchen
March 7, 2025 07:52 5m 3s develop
develop
March 7, 2025 07:52 5m 3s
Fix segmentation fault in integrate test 312_NO_GO_wfc_get_wf (#5970) Mirror to Gitee Repository #1151: Commit c7ec092 pushed by mohanchen
March 7, 2025 07:51 3m 32s develop
develop
March 7, 2025 07:51 3m 32s
perf the compute of check_atom_stru and add openmp (#5962) Mirror to Gitee Repository #1150: Commit e93d3a7 pushed by mohanchen
March 7, 2025 07:50 27s develop
develop
March 7, 2025 07:50 27s
Feature: Add HR output label for DeePKS. (#5968) Mirror to Gitee Repository #1149: Commit c8204a8 pushed by ErjieWu
March 7, 2025 07:24 29s develop
develop
March 7, 2025 07:24 29s
Performance: Optimize para_gemm and para_linear_transform (#5967) Mirror to Gitee Repository #1148: Commit 3b59b29 pushed by Qianruipku
March 7, 2025 06:47 2m 46s develop
develop
March 7, 2025 06:47 2m 46s
modify doc (#5965) Mirror to Gitee Repository #1147: Commit f1508aa pushed by mohanchen
March 7, 2025 01:13 12m 3s develop
develop
March 7, 2025 01:13 12m 3s
inline function of complexarray (#5964) Mirror to Gitee Repository #1146: Commit 0547609 pushed by mohanchen
March 7, 2025 01:13 8m 36s develop
develop
March 7, 2025 01:13 8m 36s
Update ESolver, delete pelec->charge, instead using chr defined in ES… Mirror to Gitee Repository #1145: Commit 76751ea pushed by mohanchen
March 7, 2025 01:13 30s develop
develop
March 7, 2025 01:13 30s
Refactor: Remove GlobalV in DeePKS and simplify some functions. (#5952) Mirror to Gitee Repository #1144: Commit 0aba423 pushed by mohanchen
March 5, 2025 14:19 3m 25s develop
develop
March 5, 2025 14:19 3m 25s
Fix RT-TDDFT current calculation crash using >20 MPI processes (#5959) Mirror to Gitee Repository #1143: Commit 6b928c9 pushed by mohanchen
March 5, 2025 14:17 2m 47s develop
develop
March 5, 2025 14:17 2m 47s
Update after_scf in ESolver (#5957) Mirror to Gitee Repository #1142: Commit 071e8c3 pushed by Qianruipku
March 5, 2025 06:26 28s develop
develop
March 5, 2025 06:26 28s
Perf: openmp for cal_force_stress (#5956) Mirror to Gitee Repository #1141: Commit 7f9dc96 pushed by mohanchen
March 5, 2025 06:10 2m 50s develop
develop
March 5, 2025 06:10 2m 50s
Feature: support the default as the value of dft_functional when … Mirror to Gitee Repository #1140: Commit 2825851 pushed by mohanchen
March 5, 2025 04:12 30s develop
develop
March 5, 2025 04:12 30s
Refactor:Modify the output functions in elecstate. (#5954) Mirror to Gitee Repository #1139: Commit b3bc912 pushed by mohanchen
March 5, 2025 04:10 28s develop
develop
March 5, 2025 04:10 28s
Feature: add nbands_mul for setting multiply for default nbands and f… Mirror to Gitee Repository #1138: Commit 19a1b13 pushed by mohanchen
March 4, 2025 00:58 6m 8s stable
stable
March 4, 2025 00:58 6m 8s
Refactor: remove useless head files (#5945) Mirror to Gitee Repository #1137: Commit 70b7f58 pushed by Qianruipku
March 3, 2025 08:44 11m 34s develop
develop
March 3, 2025 08:44 11m 34s
Refactor: before_scf of esolver_fp (#5943) Mirror to Gitee Repository #1136: Commit 53d83b2 pushed by mohanchen
March 3, 2025 07:19 24m 45s develop
develop
March 3, 2025 07:19 24m 45s
Delete conv_esolver in esolver, and add 'conv_esolver' as a parameter… Mirror to Gitee Repository #1135: Commit 83f966a pushed by mohanchen
March 3, 2025 01:19 37s develop
develop
March 3, 2025 01:19 37s
Remove pre-commit bot (#5942) Mirror to Gitee Repository #1134: Commit 1fa5e3a pushed by mohanchen
March 2, 2025 11:56 2m 45s develop
develop
March 2, 2025 11:56 2m 45s
add openmp support to calculate_hr (#5937) Mirror to Gitee Repository #1133: Commit 34db426 pushed by mohanchen
February 28, 2025 09:47 33s develop
develop
February 28, 2025 09:47 33s