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Feature: DFT+U for noncollinear spin calculation with PW base (#5703) Container #2397: Commit c9c0189 pushed by mohanchen
December 11, 2024 06:56 23m 25s develop
develop
December 11, 2024 06:56 23m 25s
Update Wannier90 interface document. (#5714) Container #2396: Commit 5280bd4 pushed by mohanchen
December 11, 2024 00:50 23m 47s develop
develop
December 11, 2024 00:50 23m 47s
Add support for INPUT deepks_v_delta>0 in multi-k points DeePKS calcu… Container #2395: Commit f8ef50f pushed by mohanchen
December 10, 2024 12:20 33m 0s develop
develop
December 10, 2024 12:20 33m 0s
Refactor:remove GlobalC::ucell in module_ri (#5698) Container #2394: Commit 3afb499 pushed by mohanchen
December 10, 2024 12:17 35m 7s develop
develop
December 10, 2024 12:17 35m 7s
Feature: GGA XC kernel for LR-TDDFT at nspin=2 (#5712) Container #2393: Commit 2c109a0 pushed by mohanchen
December 10, 2024 12:02 50m 1s develop
develop
December 10, 2024 12:02 50m 1s
Refactor: add smooth threshold support for bpcg method (#5709) Container #2392: Commit ab2a789 pushed by mohanchen
December 10, 2024 11:58 52m 14s develop
develop
December 10, 2024 11:58 52m 14s
update Conv_Coulomb_Pot_K::Ccp_Type (#5702) Container #2391: Commit c5d5eab pushed by mohanchen
December 10, 2024 11:57 29m 31s develop
develop
December 10, 2024 11:57 29m 31s
Refactor: add smooth threshold support for david method (#5697) Container #2390: Commit fd3a6d8 pushed by mohanchen
December 10, 2024 08:29 49m 12s develop
develop
December 10, 2024 08:29 49m 12s
update exx code format (#5701) Container #2389: Commit de90fdf pushed by mohanchen
December 10, 2024 08:27 47m 30s develop
develop
December 10, 2024 08:27 47m 30s
Fix: initialize values in module_relax/relax_new (#5696) Container #2388: Commit fe7c74a pushed by mohanchen
December 6, 2024 14:16 28m 24s develop
develop
December 6, 2024 14:16 28m 24s
Refactor:Remove GlobalC::ucell in module_lr,module_psi (#5691) Container #2387: Commit f1d6055 pushed by mohanchen
December 6, 2024 14:13 30m 5s develop
develop
December 6, 2024 14:13 30m 5s
try to remove spin_now (#5689) Container #2386: Commit d3cb289 pushed by mohanchen
December 6, 2024 14:10 39m 45s develop
develop
December 6, 2024 14:10 39m 45s
Refacor: change the order of k-point parallel and band parallel. (#5692) Container #2385: Commit 3fec10a pushed by mohanchen
December 6, 2024 14:09 31m 41s develop
develop
December 6, 2024 14:09 31m 41s
Refactor: Remove cal_nelec and cal_nbands from unitcell.cpp. (#… Container #2384: Commit f997e86 pushed by mohanchen
December 6, 2024 14:07 22m 54s develop
develop
December 6, 2024 14:07 22m 54s
refactor: move parallel_2d to module_base (#5625) Container #2383: Commit 0f79c05 pushed by mohanchen
December 5, 2024 12:12 43m 9s develop
develop
December 5, 2024 12:12 43m 9s
Fix the overwriting between xc kernel components (#5654) Container #2382: Commit df7e8a5 pushed by mohanchen
December 5, 2024 12:10 38m 24s develop
develop
December 5, 2024 12:10 38m 24s
Fix: init_mixing before beforescf (#5683) Container #2381: Commit ce1fecf pushed by mohanchen
December 5, 2024 05:46 30m 42s develop
develop
December 5, 2024 05:46 30m 42s
Update bfgs.cpp (#5656) Container #2380: Commit d1ec60e pushed by mohanchen
December 5, 2024 01:25 32m 41s develop
develop
December 5, 2024 01:25 32m 41s
Refactor: Remove the functions about pseudopotential from Unitcell. (… Container #2379: Commit 6d26194 pushed by mohanchen
December 5, 2024 01:24 23m 29s develop
develop
December 5, 2024 01:24 23m 29s
Refactor: Move the print of H(k)&S(k) and wavefunctions to after_scf.… Container #2378: Commit 02b07c6 pushed by YuLiu98
December 4, 2024 09:51 37m 45s develop
develop
December 4, 2024 09:51 37m 45s
Refactor:Remove GlobalC::ucell in module_io (#5677) Container #2377: Commit e555490 pushed by YuLiu98
December 4, 2024 04:36 23m 3s develop
develop
December 4, 2024 04:36 23m 3s
Refactor:Remove GlobalC::ucell in module_pwdft (#5658) Container #2376: Commit 3b1fa6e pushed by mohanchen
December 3, 2024 13:05 33m 0s develop
develop
December 3, 2024 13:05 33m 0s
Refactor:Remove GlobalC::ucell in module_relax (#5668) Container #2375: Commit d11ac5e pushed by mohanchen
December 3, 2024 12:55 37m 49s develop
develop
December 3, 2024 12:55 37m 49s
Refactor: remove GlobalC::Grid_D in hamilt_lcao (#5664) Container #2374: Commit a363fdf pushed by mohanchen
December 3, 2024 01:24 23m 6s develop
develop
December 3, 2024 01:24 23m 6s
Refactor:Remove GloblaC::ucell in module_hsolver (#5657) Container #2373: Commit 48065a3 pushed by mohanchen
December 2, 2024 13:50 29m 40s develop
develop
December 2, 2024 13:50 29m 40s