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disable four rarely used functionals which involves the laplacian of … Container #2227: Commit e27ac49 pushed by mohanchen
November 2, 2024 02:24 39m 35s develop
develop
November 2, 2024 02:24 39m 35s
Feature: change the default value of ecutwfc based on basis_type (#… Container #2226: Commit 18df359 pushed by mohanchen
November 2, 2024 02:24 38m 20s develop
develop
November 2, 2024 02:24 38m 20s
Fix: widen the range of support on STRU file of Molden interface (#5388) Container #2225: Commit 0f44046 pushed by mohanchen
November 1, 2024 08:19 53m 8s develop
develop
November 1, 2024 08:19 53m 8s
UT for rw_cube (#5384) Container #2224: Commit 137235d pushed by mohanchen
November 1, 2024 08:18 51m 41s develop
develop
November 1, 2024 08:18 51m 41s
Fix: force and stress calculation with noncollinear-spin or SOC for P… Container #2223: Commit e276480 pushed by mohanchen
November 1, 2024 08:17 50m 34s develop
develop
November 1, 2024 08:17 50m 34s
add the docs about deeptb (#5386) Container #2222: Commit 6cdb848 pushed by mohanchen
November 1, 2024 08:12 54m 8s develop
develop
November 1, 2024 08:12 54m 8s
Docs: update the docs about DeePKS (#5385) Container #2221: Commit 9f4d864 pushed by mohanchen
November 1, 2024 08:11 38m 19s develop
develop
November 1, 2024 08:11 38m 19s
Unify the output of BFGS, CG, and FIRE relaxation method. (#5374) Container #2220: Commit 3984296 pushed by mohanchen
October 31, 2024 06:49 38m 16s develop
develop
October 31, 2024 06:49 38m 16s
Feature: move scf_ene_thr before mix_rho (#5375) Container #2219: Commit 4d2366c pushed by mohanchen
October 31, 2024 05:20 1h 26m 0s develop
develop
October 31, 2024 05:20 1h 26m 0s
Feature: make init stochastic WF support GPU (#5365) Container #2218: Commit 4294ee7 pushed by mohanchen
October 31, 2024 04:20 1h 42m 19s develop
develop
October 31, 2024 04:20 1h 42m 19s
Refactor IO cube (#5362) Container #2217: Commit 705dad7 pushed by mohanchen
October 31, 2024 04:13 1h 11m 14s develop
develop
October 31, 2024 04:13 1h 11m 14s
docs: replace sphinx-rtd-theme with sphinx-book-theme (#5360) Container #2216: Commit 4e53045 pushed by mohanchen
October 30, 2024 06:13 2h 1m 24s develop
develop
October 30, 2024 06:13 2h 1m 24s
Refactor: move print_rhofft and print_wfcfft to ModuleIO (#5358) Container #2215: Commit fe3b44f pushed by mohanchen
October 29, 2024 05:15 52m 1s develop
develop
October 29, 2024 05:15 52m 1s
Feature: make SCF converges only if drho and dene is smaller than thr… Container #2214: Commit 821b184 pushed by mohanchen
October 29, 2024 04:59 1h 2m 55s develop
develop
October 29, 2024 04:59 1h 2m 55s
fix the symmetry condition in rpa (#5355) Container #2213: Commit f33650f pushed by mohanchen
October 29, 2024 04:58 47m 18s develop
develop
October 29, 2024 04:58 47m 18s
fix build scripts (#5350) Container #2212: Commit 7a29e2f pushed by mohanchen
October 26, 2024 03:51 53m 11s develop
develop
October 26, 2024 03:51 53m 11s
Change the default setting for symmetry when berry_phase=1 (#5349) Container #2211: Commit 066dfbb pushed by mohanchen
October 26, 2024 03:50 52m 24s develop
develop
October 26, 2024 03:50 52m 24s
Feature: MPI available on ABACUS DSP version (#5351) Container #2210: Commit 72d9d1d pushed by mohanchen
October 26, 2024 03:49 37m 20s develop
develop
October 26, 2024 03:49 37m 20s
Refactor: Organize code structure to improve maintainability in pyaba… Container #2209: Commit 729059f pushed by mohanchen
October 25, 2024 01:19 51m 13s develop
develop
October 25, 2024 01:19 51m 13s
fix exxsym (#5348) Container #2208: Commit e4044a4 pushed by mohanchen
October 25, 2024 01:17 37m 33s develop
develop
October 25, 2024 01:17 37m 33s
Fix: Fix Consts memory leak by directly removing custome consts (#5344) Container #2207: Commit 5a774bf pushed by mohanchen
October 24, 2024 14:10 48m 15s develop
develop
October 24, 2024 14:10 48m 15s
Fix: do not bcast my_rank (#5339) Container #2206: Commit d7150d0 pushed by Qianruipku
October 24, 2024 09:39 37m 44s develop
develop
October 24, 2024 09:39 37m 44s
Feature: Add Cell for pyabacus (#5247) Container #2205: Commit 1b3f76e pushed by mohanchen
October 24, 2024 05:15 39m 22s develop
develop
October 24, 2024 05:15 39m 22s
Remove install_dsp.sh (#5337) Container #2204: Commit 2dc9803 pushed by mohanchen
October 24, 2024 05:15 37m 44s develop
develop
October 24, 2024 05:15 37m 44s
Remove diagh.h in module_hsolver (#5332) Container #2203: Commit 4ded80e pushed by mohanchen
October 23, 2024 17:42 56m 27s develop
develop
October 23, 2024 17:42 56m 27s