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297 workflow run results
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Remove DiagH class in hsolver (#5307) Doxygen Documentation Deployment #497: Commit 5a6f494 pushed by mohanchen
2h 30m 50s develop
develop
2h 30m 50s
Refactor: replace sto_hchi by HamiltSdftPW::hPsi (#5298) Doxygen Documentation Deployment #496: Commit 7194eb7 pushed by mohanchen
1m 17s develop
develop
1m 17s
Feature: LR-TDDFT for open-shell systems (#5312) Doxygen Documentation Deployment #495: Commit 0bac03f pushed by mohanchen
1m 39s develop
develop
1m 39s
Add number of threads output in stdout (#5281) Doxygen Documentation Deployment #494: Commit 3203ec6 pushed by mohanchen
33s develop
develop
33s
remove read_rho and make read_cube independent of esolver_type (#5323) Doxygen Documentation Deployment #493: Commit efb83c8 pushed by YuLiu98
18m 21s develop
develop
18m 21s
doc: fix typo in kpt.md (#5320) Doxygen Documentation Deployment #492: Commit 8a02642 pushed by mohanchen
6m 57s develop
develop
6m 57s
fix nspin=4 error (#5319) Doxygen Documentation Deployment #491: Commit 6632c0b pushed by mohanchen
33s develop
develop
33s
Fix: makefile cannot compile without openmp (#5316) Doxygen Documentation Deployment #490: Commit 3eac0e2 pushed by mohanchen
1m 0s develop
develop
1m 0s
Update version.h (#5314) Doxygen Documentation Deployment #489: Commit 146a509 pushed by WHUweiqingzhou
3m 41s develop
develop
3m 41s
Refactor XC_Functional_Libxc::convert_vtxc_v() (#5212) Doxygen Documentation Deployment #488: Commit 39c29d3 pushed by mohanchen
15m 22s develop
develop
15m 22s
set two_fermi to false for nspin == 1 and add extra checks (#5305) Doxygen Documentation Deployment #487: Commit 5ccb292 pushed by mohanchen
5m 29s develop
develop
5m 29s
remove nspin dependence form Gint (#5304) Doxygen Documentation Deployment #486: Commit 7fdb1a3 pushed by mohanchen
44s develop
develop
44s
Fix a segfault in rhog_symmetry (#5303) Doxygen Documentation Deployment #485: Commit f636d74 pushed by mohanchen
2m 20s develop
develop
2m 20s
Sorting out the calculation logic of pexsi in hsolver-lcao (#5299) Doxygen Documentation Deployment #484: Commit 255e104 pushed by mohanchen
1m 6s develop
develop
1m 6s
Becke's partition for multi-center grid integration (#5292) Doxygen Documentation Deployment #483: Commit 7cb7664 pushed by mohanchen
1m 31s develop
develop
1m 31s
Modify the berry phase document. (#5293) Doxygen Documentation Deployment #482: Commit 1a11dac pushed by mohanchen
3m 29s develop
develop
3m 29s
Refactor: Use memory_op to set diag_const_nums (#5246) Doxygen Documentation Deployment #481: Commit 545d2ec pushed by mohanchen
15m 35s develop
develop
15m 35s
Doc&Test: update the documentation about pseudopotential and orbitals… Doxygen Documentation Deployment #480: Commit 08ea40c pushed by mohanchen
1m 10s develop
develop
1m 10s
fix some incorrect INPUT files (#5284) Doxygen Documentation Deployment #479: Commit 44076aa pushed by mohanchen
2m 19s develop
develop
2m 19s
Refactor: Seperate BLAS functions' declaration and implementation, an… Doxygen Documentation Deployment #478: Commit 60c1f77 pushed by mohanchen
20m 42s develop
develop
20m 42s
remove unnecessary gpu memory allocation under LCAO basis (#5258) Doxygen Documentation Deployment #477: Commit cfffc78 pushed by mohanchen
1m 5s develop
develop
1m 5s
Refactor: refactor solve func in hsolver-lcao class (#5257) Doxygen Documentation Deployment #476: Commit 7938206 pushed by mohanchen
1m 7s develop
develop
1m 7s
Remove DiagH of lcao PEXSI (#5259) Doxygen Documentation Deployment #475: Commit 3aec2be pushed by mohanchen
43s develop
develop
43s
Refactor class DensityMatrix: remove the dependence on K_Vectors … Doxygen Documentation Deployment #474: Commit 6d4e946 pushed by mohanchen
33m 17s develop
develop
33m 17s
Remove Base class DiagH in LCAO code (#5239) Doxygen Documentation Deployment #473: Commit 590ea5e pushed by mohanchen
8m 49s develop
develop
8m 49s
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