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Add some timers related to FFT (#6537) Container #2868: Commit 2a098b2 pushed by mohanchen
32m 14s develop
develop
32m 14s
Added the serial version incorporating code changes from #6487 and #6… Container #2867: Commit 9438146 pushed by dyzheng
17m 45s LTS
LTS
17m 45s
Move some codes out of esolver_fp (#6527) Container #2866: Commit 860ce0f pushed by sunliang98
23m 54s develop
develop
23m 54s
Fix: Plug memory leak in dav_subspace (#6532) Container #2865: Commit 4289cec pushed by mohanchen
19m 20s develop
develop
19m 20s
docs: Added keyword descriptions for the DFT-1/2 method. (#6528) Container #2864: Commit bb0d003 pushed by mohanchen
38m 22s develop
develop
38m 22s
Refactor: Simplify EXX related code in ESolver_KS_PW (#6530) Container #2863: Commit 18f1c79 pushed by mohanchen
19m 20s develop
develop
19m 20s
Update output formats, prepare for ABACUS 3.11 version (#6522) Container #2862: Commit 073f7dc pushed by mohanchen
35m 7s develop
develop
35m 7s
Activate PW/GPU test for out_wfc_pw (#6523) Container #2861: Commit 8a632e9 pushed by mohanchen
59m 56s develop
develop
59m 56s
change fflush to flush (#6521) Container #2860: Commit 8ea115b pushed by mohanchen
21m 43s develop
develop
21m 43s
Feature: add DFT-1/2 and shell DFT-1/2, only support PW esolvers_ks_p… Container #2859: Commit 002786e pushed by mohanchen
1h 44m 3s develop
develop
1h 44m 3s
fix memory leak (#6515) Container #2858: Commit 99720fe pushed by mohanchen
1h 37m 49s develop
develop
1h 37m 49s
fix output bug (#6518) Container #2857: Commit 305b7d6 pushed by mohanchen
1h 8m 40s develop
develop
1h 8m 40s
Fix a minor bug in v_xc timer (#6514) Container #2856: Commit cb5ae35 pushed by mohanchen
19m 57s develop
develop
19m 57s
[Refactor] Move module_fft to source_base (#6508) Container #2855: Commit 07658be pushed by mohanchen
52m 8s develop
develop
52m 8s
Refactor: EXX PW Code Structure (#6431) Container #2854: Commit 1bea8dd pushed by mohanchen
1h 25m 49s develop
develop
1h 25m 49s
1. Improve output accuracy of Exx_Opt_Orb (#6509) Container #2853: Commit 3d1a861 pushed by mohanchen
36m 29s develop
develop
36m 29s
Tests: Update DeePKS UT to make sure it covers some checks. (#6480) Container #2852: Commit c931d97 pushed by mohanchen
2h 17m 7s develop
develop
2h 17m 7s
fix: psi error for large system (#6501) Container #2851: Commit c3ff007 pushed by mohanchen
1h 24m 44s develop
develop
1h 24m 44s
Refactor: change cal_proj() to cal_mul() in Exx_Opt_Orb (#6506) Container #2850: Commit bf2ff91 pushed by mohanchen
1h 4m 36s develop
develop
1h 4m 36s
Removed the temporary variable hRGintCd when transitioning from 2D bl… Container #2849: Commit 0f13efe pushed by dyzheng
16m 11s LTS
LTS
16m 11s
correct an output in LR hsolver (#6503) Container #2848: Commit 10a9c41 pushed by mohanchen
1h 3m 32s develop
develop
1h 3m 32s
Fix : add overlap output for deepks_out_freq_elec (#6505) Container #2847: Commit e5500e5 pushed by mohanchen
45m 30s develop
develop
45m 30s
Update version to 3.9.0.14 (#6504) Container #2846: Commit 338dffa pushed by ErjieWu
18m 50s v3.9.0.14
v3.9.0.14
18m 50s
Update version to 3.9.0.14 (#6504) Container #2845: Commit 338dffa pushed by sunliang98
35m 46s develop
develop
35m 46s
Removed the temporary variable DMRGint_full when transitioning from 2… Container #2844: Commit 0817e32 pushed by mohanchen
27m 13s develop
develop
27m 13s
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