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Restore compatibility between lr_eig and real_eig
CI #1248: Commit 5766764 pushed by sunqm
November 21, 2024 19:31 50m 32s tdhf-diagonalization
November 21, 2024 19:31 50m 32s
Add geometry optimization examples
CI #1247: Commit 7b5cbfd pushed by sunqm
November 21, 2024 18:14 51m 28s small-fixes
November 21, 2024 18:14 51m 28s
Add geometry optimization examples
Lint #1166: Commit 7b5cbfd pushed by sunqm
November 21, 2024 18:14 50s small-fixes
November 21, 2024 18:14 50s
Fix compiling errors in the mp module
Lint #1165: Commit ad48a00 pushed by sunqm
November 21, 2024 18:10 47s mp-compling-error
November 21, 2024 18:10 47s
Fix compiling errors in the mp module
CI #1246: Commit ad48a00 pushed by sunqm
November 21, 2024 18:10 50m 32s mp-compling-error
November 21, 2024 18:10 50m 32s
Update dependency in CI jobs
CI #1245: Commit 87097e6 pushed by sunqm
November 20, 2024 17:13 51m 37s update_libxc
November 20, 2024 17:13 51m 37s
Update dependency in CI jobs
Lint #1164: Commit 87097e6 pushed by sunqm
November 20, 2024 17:13 47s update_libxc
November 20, 2024 17:13 47s
error introduced in previous commit
Lint #1163: Commit fd3dcd9 pushed by sunqm
November 20, 2024 16:25 48s sr-only-rsh
November 20, 2024 16:25 48s
error introduced in previous commit
CI #1244: Commit fd3dcd9 pushed by sunqm
November 20, 2024 16:25 49m 36s sr-only-rsh
November 20, 2024 16:25 49m 36s
Update _lr_eig
Lint #1162: Commit 70b5f0f pushed by sunqm
November 20, 2024 14:54 53s sr-only-rsh
November 20, 2024 14:54 53s
Update _lr_eig
CI #1243: Commit 70b5f0f pushed by sunqm
November 20, 2024 14:54 48m 36s sr-only-rsh
November 20, 2024 14:54 48m 36s
Fix pbc.tdscf tests and update docstrings
CI #1242: Commit e2735b6 pushed by sunqm
November 19, 2024 05:01 48m 37s sr-only-rsh
November 19, 2024 05:01 48m 37s
Fix pbc.tdscf tests and update docstrings
Lint #1161: Commit e2735b6 pushed by sunqm
November 19, 2024 05:01 45s sr-only-rsh
November 19, 2024 05:01 45s
Fix x2c.tdscf
CI #1241: Commit f99dc51 pushed by sunqm
November 19, 2024 04:43 50m 37s 2246
November 19, 2024 04:43 50m 37s
Fix x2c.tdscf
Lint #1160: Commit f99dc51 pushed by sunqm
November 19, 2024 04:43 48s 2246
November 19, 2024 04:43 48s
Align the strucure of TDDFT amplitudes with the CIS convention (fix #…
Lint #1159: Commit 9a8c48a pushed by sunqm
November 18, 2024 16:27 50s 2246
November 18, 2024 16:27 50s
Align the strucure of TDDFT amplitudes with the CIS convention (fix #…
CI #1240: Commit 9a8c48a pushed by sunqm
November 18, 2024 16:27 50m 48s 2246
November 18, 2024 16:27 50m 48s
Drop invalid test
Lint #1158: Commit 017e12e pushed by sunqm
November 17, 2024 16:15 56s sr-only-rsh
November 17, 2024 16:15 56s
Drop invalid test
CI #1239: Commit 017e12e pushed by sunqm
November 17, 2024 16:15 50m 13s sr-only-rsh
November 17, 2024 16:15 50m 13s
Update DFT-D3 example
Lint #1157: Commit 6e226d9 pushed by sunqm
November 17, 2024 16:12 48s small-fixes
November 17, 2024 16:12 48s
Update DFT-D3 example
CI #1238: Commit 6e226d9 pushed by sunqm
November 17, 2024 16:12 52m 56s small-fixes
November 17, 2024 16:12 52m 56s
Fix undefined variable in tdscf._lr_eig
CI #1237: Commit d93d403 pushed by sunqm
November 17, 2024 00:50 51m 55s small-fixes
November 17, 2024 00:50 51m 55s
Fix undefined variable in tdscf._lr_eig
Lint #1156: Commit d93d403 pushed by sunqm
November 17, 2024 00:50 49s small-fixes
November 17, 2024 00:50 49s
Exclude kpt, kpts and some attributes from to_gpu function
CI #1236: Commit fee6c15 pushed by sunqm
November 17, 2024 00:25 50m 58s small-fixes
November 17, 2024 00:25 50m 58s
Exclude kpt, kpts and some attributes from to_gpu function
Lint #1155: Commit fee6c15 pushed by sunqm
November 17, 2024 00:25 49s small-fixes
November 17, 2024 00:25 49s