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Perf: change default pw_seed=0 (#5179) Mirror to Gitee Repository #613: Commit 22964f0 pushed by kirk0830
September 28, 2024 06:07 4s kirk0830-patch-1
kirk0830-patch-1
September 28, 2024 06:07 4s
Perf: change default pw_seed=0 (#5179) Mirror to Gitee Repository #611: Commit 22964f0 pushed by mohanchen
September 27, 2024 12:39 11m 10s develop
develop
September 27, 2024 12:39 11m 10s
small fix in LR (#5187) Mirror to Gitee Repository #610: Commit 7014205 pushed by mohanchen
September 27, 2024 12:37 2m 17s develop
develop
September 27, 2024 12:37 2m 17s
optimize td_current and fix timer (#5181) Mirror to Gitee Repository #609: Commit ec1882f pushed by mohanchen
September 27, 2024 12:36 3m 22s develop
develop
September 27, 2024 12:36 3m 22s
Feature: Calculate and output electron localization function (ELF) wi… Mirror to Gitee Repository #608: Commit d6657ec pushed by mohanchen
September 27, 2024 12:35 33s develop
develop
September 27, 2024 12:35 33s
Fix: let only one rank do file I/O in unittest of orb_io (#5185) Mirror to Gitee Repository #607: Commit 1c7a509 pushed by WHUweiqingzhou
September 27, 2024 09:16 27m 25s develop
develop
September 27, 2024 09:16 27m 25s
Fix: recover the wannier90 interface for lcao_in_pw case (#5177) Mirror to Gitee Repository #606: Commit ba0cb21 pushed by WHUweiqingzhou
September 26, 2024 05:39 33s develop
develop
September 26, 2024 05:39 33s
Fix: Update function calls in pyabacus to align with new function s… Mirror to Gitee Repository #605: Commit 3b2e5ad pushed by mohanchen
September 26, 2024 04:04 5m 44s develop
develop
September 26, 2024 04:04 5m 44s
Radial quadrature grid (#5173) Mirror to Gitee Repository #604: Commit 4f2e453 pushed by mohanchen
September 26, 2024 04:02 2m 33s develop
develop
September 26, 2024 04:02 2m 33s
Fix: timer not closed in TDDFT code (#5172) Mirror to Gitee Repository #603: Commit 954c358 pushed by mohanchen
September 26, 2024 04:00 33s develop
develop
September 26, 2024 04:00 33s
Fix: init_chg wfc support npsin = 4 now (#5166) Mirror to Gitee Repository #602: Commit e32341a pushed by Qianruipku
September 25, 2024 08:15 6m 8s develop
develop
September 25, 2024 08:15 6m 8s
Fix: bug of cal_ux (#5165) Mirror to Gitee Repository #601: Commit fb5beba pushed by Qianruipku
September 24, 2024 12:17 31s develop
develop
September 24, 2024 12:17 31s
Fix docs according to #5133 (#5169) Mirror to Gitee Repository #600: Commit ca5cc95 pushed by mohanchen
September 24, 2024 11:53 4m 10s develop
develop
September 24, 2024 11:53 4m 10s
use ELPA_WITH_NVIDIA_GPU_VERSION to judge elpa setup gpu (#5163) Mirror to Gitee Repository #599: Commit b8b3829 pushed by mohanchen
September 24, 2024 11:53 36s develop
develop
September 24, 2024 11:53 36s
Fix: add MPI_Barrier when necessary to avoid unexpected behavoir (#5167) Mirror to Gitee Repository #598: Commit 286cdc5 pushed by kirk0830
September 24, 2024 06:53 13m 10s develop
develop
September 24, 2024 06:53 13m 10s
Refactor: refactor hsolver-lcao func (#5148) Mirror to Gitee Repository #597: Commit b083759 pushed by mohanchen
September 24, 2024 04:47 5m 9s develop
develop
September 24, 2024 04:47 5m 9s
Fix: fix a bug in diago_elpa_native.cpp (#5155) Mirror to Gitee Repository #596: Commit 6212f84 pushed by mohanchen
September 24, 2024 04:42 4m 54s develop
develop
September 24, 2024 04:42 4m 54s
Fix: wrong STRU read in md restart case (#5157) Mirror to Gitee Repository #595: Commit f356958 pushed by mohanchen
September 24, 2024 04:40 36s develop
develop
September 24, 2024 04:40 36s
Perf&Refactor: optimize the performanace of psi_initializer with omp … Mirror to Gitee Repository #594: Commit eab9d73 pushed by mohanchen
September 24, 2024 04:36 34s develop
develop
September 24, 2024 04:36 34s
Toolchain 202403 (#5144) Mirror to Gitee Repository #593: Commit acb792d pushed by mohanchen
September 23, 2024 12:46 5m 0s develop
develop
September 23, 2024 12:46 5m 0s
Fix the undefined behavior in sph_bessel_recursive (#5158) Mirror to Gitee Repository #592: Commit 81f2541 pushed by mohanchen
September 23, 2024 12:43 3m 42s develop
develop
September 23, 2024 12:43 3m 42s
Refactor: remove useless warning for dp (#5153) Mirror to Gitee Repository #591: Commit 7c8a4da pushed by mohanchen
September 21, 2024 07:44 2m 53s develop
develop
September 21, 2024 07:44 2m 53s
Refactor: add CalAtomsInfo to modify parameter (#5132) Mirror to Gitee Repository #590: Commit 90e4921 pushed by mohanchen
September 21, 2024 07:42 30s develop
develop
September 21, 2024 07:42 30s
add ipool != 0 return (#5145) Mirror to Gitee Repository #589: Commit 80b2c75 pushed by mohanchen
September 20, 2024 14:05 6m 30s develop
develop
September 20, 2024 14:05 6m 30s
Fix read/write HexxR at nspin=4 (#5142) Mirror to Gitee Repository #588: Commit 75f1e6d pushed by mohanchen
September 20, 2024 14:03 4m 17s develop
develop
September 20, 2024 14:03 4m 17s