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Fix the transformation matrix of Mole.decontracted_basis (fix #2348)
CI #1142: Commit 0e808f2 pushed by sunqm
August 5, 2024 19:48 51m 32s 2348
August 5, 2024 19:48 51m 32s
Merge branch 'master' into 2258
Lint #1059: Commit 5a683bd pushed by sunqm
August 5, 2024 06:49 49s 2258
August 5, 2024 06:49 49s
Merge branch 'master' into 2258
CI #1140: Commit 5a683bd pushed by sunqm
August 5, 2024 06:49 50m 53s 2258
August 5, 2024 06:49 50m 53s
Merge branch '2.7' into optimize-fft
Lint #1058: Commit 34e1ae8 pushed by sunqm
August 5, 2024 06:48 46s optimize-fft
August 5, 2024 06:48 46s
Merge branch '2.7' into optimize-fft
CI #1139: Commit 34e1ae8 pushed by sunqm
August 5, 2024 06:48 51m 10s optimize-fft
August 5, 2024 06:48 51m 10s
Fix smearning-ROHF
Lint #1057: Commit 0f4962e pushed by sunqm
August 5, 2024 06:13 46s 2289
August 5, 2024 06:13 46s
Fix smearning-ROHF
CI #1138: Commit 0f4962e pushed by sunqm
August 5, 2024 06:13 51m 24s 2289
August 5, 2024 06:13 51m 24s
July 8, 2024 16:52 51m 15s
July 8, 2024 16:52 49s
Fix import dependency issue in SCF.do_disp()
CI #1136: Commit 18479d7 pushed by sunqm
July 8, 2024 05:06 51m 17s 2292
July 8, 2024 05:06 51m 17s
Fix import dependency issue in SCF.do_disp()
Lint #1055: Commit 18479d7 pushed by sunqm
July 8, 2024 05:06 47s 2292
July 8, 2024 05:06 47s
typo
CI #1135: Commit 31ca7bf pushed by sunqm
July 8, 2024 03:11 50m 27s 2302
July 8, 2024 03:11 50m 27s
typo
Lint #1054: Commit 31ca7bf pushed by sunqm
July 8, 2024 03:11 47s 2302
July 8, 2024 03:11 47s
Handle api changes in scipy-1.14
CI #1134: Commit a320047 pushed by sunqm
July 8, 2024 02:50 7m 44s 2302
July 8, 2024 02:50 7m 44s
Handle api changes in scipy-1.14
Lint #1053: Commit a320047 pushed by sunqm
July 8, 2024 02:50 48s 2302
July 8, 2024 02:50 48s
Handle api changes in scipy-1.14
CI #1133: Commit a8070b1 pushed by sunqm
July 8, 2024 02:40 7m 44s 2302
July 8, 2024 02:40 7m 44s
Handle api changes in scipy-1.14
Lint #1052: Commit a8070b1 pushed by sunqm
July 8, 2024 02:40 49s 2302
July 8, 2024 02:40 49s
Merge branch '2.7' into optimize-fft
CI #1132: Commit e4e2b8b pushed by sunqm
July 8, 2024 01:30 50m 54s optimize-fft
July 8, 2024 01:30 50m 54s
Merge branch '2.7' into optimize-fft
Lint #1051: Commit e4e2b8b pushed by sunqm
July 8, 2024 01:30 47s optimize-fft
July 8, 2024 01:30 47s
July 8, 2024 01:03 45s
July 8, 2024 01:03 50m 13s
Handle undefined attributes in Cell.to_mol()
Lint #1049: Commit 469de01 pushed by sunqm
June 22, 2024 04:32 50s frac-coords
June 22, 2024 04:32 50s
Handle undefined attributes in Cell.to_mol()
CI #1130: Commit 469de01 pushed by sunqm
June 22, 2024 04:32 49m 54s frac-coords
June 22, 2024 04:32 49m 54s