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Refactor: remove the Psi Constructors using int* ngk_in (#5745)
Doxygen Documentation Deployment #717: Commit 91b0281 pushed by mohanchen
December 24, 2024 12:50 13m 18s develop
December 24, 2024 12:50 13m 18s
Feature: enable cal_force and cal_stress in nscf (#5752)
Doxygen Documentation Deployment #716: Commit dc7147d pushed by mohanchen
December 24, 2024 12:48 2m 50s develop
December 24, 2024 12:48 2m 50s
update the docs of exx_ccp_rmesh_times and exx_real_number (#5758)
Doxygen Documentation Deployment #715: Commit 25865a9 pushed by mohanchen
December 24, 2024 12:45 2m 8s develop
December 24, 2024 12:45 2m 8s
Refactor: refactor neighbour atom search but no change on algo (#5759)
Doxygen Documentation Deployment #714: Commit e315694 pushed by mohanchen
December 24, 2024 12:45 1m 4s develop
December 24, 2024 12:45 1m 4s
Refactor: split pseudopot_cell_vl and pseudopot_cell_vnl (#5743)
Doxygen Documentation Deployment #713: Commit 38cef80 pushed by mohanchen
December 19, 2024 09:08 5m 38s develop
December 19, 2024 09:08 5m 38s
Refactor: remove GlobalC::Pgrid (#5740)
Doxygen Documentation Deployment #712: Commit 68248c6 pushed by Qianruipku
December 19, 2024 02:19 3m 39s develop
December 19, 2024 02:19 3m 39s
Refactor:Remove GlobalC::ucell (#5737)
Doxygen Documentation Deployment #711: Commit c611100 pushed by mohanchen
December 18, 2024 11:29 12m 26s develop
December 18, 2024 11:29 12m 26s
Fix: Segment Fault of PAW (#5738)
Doxygen Documentation Deployment #710: Commit f0ff82b pushed by mohanchen
December 18, 2024 03:05 1h 4m 48s develop
December 18, 2024 03:05 1h 4m 48s
Docs: move doxygen to headers for DiagoDavid class and add some new (…
Doxygen Documentation Deployment #709: Commit 0317913 pushed by mohanchen
December 17, 2024 04:42 3m 51s develop
December 17, 2024 04:42 3m 51s
Refactor: remove GlobalC::solvent_model (#5735)
Doxygen Documentation Deployment #708: Commit c1cb6ac pushed by mohanchen
December 16, 2024 12:09 7m 19s develop
December 16, 2024 12:09 7m 19s
Feature: add smooth ethr for all iter methods (#5732)
Doxygen Documentation Deployment #707: Commit 72bd505 pushed by mohanchen
December 16, 2024 12:05 4m 10s develop
December 16, 2024 12:05 4m 10s
Refactor:remove GlobalC::ucell in module_elesctate (#5730)
Doxygen Documentation Deployment #706: Commit 815bff5 pushed by mohanchen
December 16, 2024 12:05 1m 3s develop
December 16, 2024 12:05 1m 3s
Refactor: Change some functions in module_deepks into template. (#5731)
Doxygen Documentation Deployment #705: Commit 5c815a1 pushed by mohanchen
December 16, 2024 04:16 5m 24s develop
December 16, 2024 04:16 5m 24s
update bfgs_trad method (#5662)
Doxygen Documentation Deployment #704: Commit c099d03 pushed by mohanchen
December 14, 2024 01:19 10m 48s develop
December 14, 2024 01:19 10m 48s
Fix: update kinetic energy when all atoms are fixed (#5729)
Doxygen Documentation Deployment #703: Commit 89df0f2 pushed by mohanchen
December 14, 2024 01:14 5m 46s develop
December 14, 2024 01:14 5m 46s
update version (#5726)
Doxygen Documentation Deployment #702: Commit e35b4bf pushed by mohanchen
December 14, 2024 01:12 2m 11s develop
December 14, 2024 01:12 2m 11s
Feature: Allow directly compiling CUDA version on DCU harware (#5727)
Doxygen Documentation Deployment #701: Commit ccd2874 pushed by mohanchen
December 13, 2024 07:20 3m 41s develop
December 13, 2024 07:20 3m 41s
Refactor: add const for Grid_Driver (#5725)
Doxygen Documentation Deployment #700: Commit 4891b2e pushed by mohanchen
December 13, 2024 04:06 3m 37s develop
December 13, 2024 04:06 3m 37s
Refactor: remove GlobalC::GridD (#5720)
Doxygen Documentation Deployment #699: Commit 1f9779d pushed by mohanchen
December 12, 2024 08:41 4m 23s develop
December 12, 2024 08:41 4m 23s
Refactor: Combine gamma-only and multi-k versions of some functions i…
Doxygen Documentation Deployment #698: Commit d73b1d2 pushed by mohanchen
December 12, 2024 00:55 7m 30s develop
December 12, 2024 00:55 7m 30s
Fix: Fix the Ewald force and stress when atom number of some elements…
Doxygen Documentation Deployment #697: Commit 3b3466e pushed by mohanchen
December 12, 2024 00:54 1m 35s develop
December 12, 2024 00:54 1m 35s
add check for smearing_method (#5718)
Doxygen Documentation Deployment #696: Commit 7b33110 pushed by mohanchen
December 11, 2024 12:23 3m 35s develop
December 11, 2024 12:23 3m 35s
Fixed the bug of wannier90 interface (#5719)
Doxygen Documentation Deployment #695: Commit 7c36c49 pushed by YuLiu98
December 11, 2024 11:39 3m 43s develop
December 11, 2024 11:39 3m 43s
Docs: Gitee repo info and toolchain info update (#5666)
Doxygen Documentation Deployment #694: Commit ea3a0dd pushed by mohanchen
December 11, 2024 09:33 7m 56s develop
December 11, 2024 09:33 7m 56s
Refactor: add smooth threshold support for cg method (#5713)
Doxygen Documentation Deployment #693: Commit 4b88ee8 pushed by mohanchen
December 11, 2024 09:32 1m 25s develop
December 11, 2024 09:32 1m 25s