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Search libxc in .local/lib
self hosted CI #682: Pull request #282 opened by wxj6000
December 12, 2024 06:19 27m 11s libxc_dir
December 12, 2024 06:19 27m 11s
Support multi-GPU for direct SCF algorithms
self hosted CI #681: Pull request #276 synchronize by wxj6000
December 12, 2024 05:07 27m 13s multi-gpu-2
December 12, 2024 05:07 27m 13s
Support multi-GPU for direct SCF algorithms
self hosted CI #680: Pull request #276 synchronize by wxj6000
December 12, 2024 03:35 1h 15m 58s multi-gpu-2
December 12, 2024 03:35 1h 15m 58s
Int1e 1st derivative
self hosted CI #679: Pull request #281 opened by henryw7
December 12, 2024 00:42 29m 49s bytedance:int1e_1st_derivative
December 12, 2024 00:42 29m 49s
Optimize hessian (#265)
self hosted CI #678: Commit 010ca2d pushed by wxj6000
December 11, 2024 22:29 27m 9s master
December 11, 2024 22:29 27m 9s
support non-symmetric int3c2e (#280)
self hosted CI #677: Commit 65e3365 pushed by wxj6000
December 11, 2024 20:52 27m 29s master
December 11, 2024 20:52 27m 29s
Optimize hessian
self hosted CI #676: Pull request #265 synchronize by sunqm
December 11, 2024 20:13 27m 18s sunqm:optimize-hessian
December 11, 2024 20:13 27m 18s
Optimize hessian
self hosted CI #675: Pull request #265 synchronize by sunqm
December 11, 2024 18:17 39m 27s sunqm:optimize-hessian
December 11, 2024 18:17 39m 27s
Support non-symmetric int3c2e
self hosted CI #674: Pull request #280 opened by wxj6000
December 11, 2024 18:03 27m 37s bugfix-int3c2e_slice
December 11, 2024 18:03 27m 37s
Change license to Apache2
self hosted CI #673: Pull request #277 opened by sunqm
December 11, 2024 04:44 27m 34s sunqm:new-license
December 11, 2024 04:44 27m 34s
More PBC modules (#264)
self hosted CI #672: Commit 4386b44 pushed by wxj6000
December 11, 2024 00:57 1h 13m 14s master
December 11, 2024 00:57 1h 13m 14s
More PBC modules
self hosted CI #671: Pull request #264 synchronize by wxj6000
December 11, 2024 00:50 53m 38s sunqm:pbc-cupy
December 11, 2024 00:50 53m 38s
More PBC modules
self hosted CI #670: Pull request #264 synchronize by wxj6000
December 11, 2024 00:49 27m 26s sunqm:pbc-cupy
December 11, 2024 00:49 27m 26s
Optimize hessian
self hosted CI #669: Pull request #265 synchronize by sunqm
December 11, 2024 00:00 24m 31s sunqm:optimize-hessian
December 11, 2024 00:00 24m 31s
Support multi-GPU for direct SCF algorithms
self hosted CI #668: Pull request #276 synchronize by wxj6000
December 10, 2024 23:30 27m 2s multi-gpu-2
December 10, 2024 23:30 27m 2s
Optimize hessian
self hosted CI #667: Pull request #265 synchronize by sunqm
December 10, 2024 20:03 1h 13m 50s sunqm:optimize-hessian
December 10, 2024 20:03 1h 13m 50s
More PBC modules
self hosted CI #666: Pull request #264 synchronize by sunqm
December 10, 2024 20:02 50m 20s sunqm:pbc-cupy
December 10, 2024 20:02 50m 20s
More PBC modules
self hosted CI #665: Pull request #264 synchronize by sunqm
December 10, 2024 20:01 24m 10s sunqm:pbc-cupy
December 10, 2024 20:01 24m 10s
Optimize hessian
self hosted CI #664: Pull request #265 synchronize by sunqm
December 10, 2024 19:49 24m 46s sunqm:optimize-hessian
December 10, 2024 19:49 24m 46s
Release v1.2 (#274)
self hosted CI #663: Commit 5811bb4 pushed by sunqm
December 9, 2024 18:58 26m 19s master
December 9, 2024 18:58 26m 19s
Release v1.2
self hosted CI #662: Pull request #274 opened by wxj6000
December 9, 2024 00:36 26m 31s release_v1.2
December 9, 2024 00:36 26m 31s
Automatically apply SCF initial guess from existing wavefunction (#269)
self hosted CI #661: Commit 56f4378 pushed by sunqm
December 6, 2024 23:23 28m 7s master
December 6, 2024 23:23 28m 7s
Automatically apply SCF initial guess from existing wavefunction
self hosted CI #660: Pull request #269 synchronize by sunqm
December 6, 2024 22:55 26m 13s sunqm:scf-initial-guess
December 6, 2024 22:55 26m 13s
Automatically apply SCF initial guess from existing wavefunction
self hosted CI #659: Pull request #269 synchronize by sunqm
December 6, 2024 22:09 26m 16s sunqm:scf-initial-guess
December 6, 2024 22:09 26m 16s
Automatically apply SCF initial guess from existing wavefunction
self hosted CI #658: Pull request #269 synchronize by sunqm
December 6, 2024 15:57 26m 49s sunqm:scf-initial-guess
December 6, 2024 15:57 26m 49s