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Fix bug in set_geom when unit="Ang" is specified (#3081) CI #25: Commit 88754a2 pushed by jonas-greiner
2h 41m 26s master
master
2h 41m 26s
Fix bug in set_geom when unit="Ang" is specified (#3081) Lint #25: Commit 88754a2 pushed by jonas-greiner
55s master
master
55s
Merge remote-tracking branch 'upstream/master' into fourth_moment Lint #24: Commit 41d10bd pushed by jonas-greiner
48s fourth_moment
fourth_moment
48s
Merge remote-tracking branch 'upstream/master' into fourth_moment CI #24: Commit 41d10bd pushed by jonas-greiner
2h 18m 45s fourth_moment
fourth_moment
2h 18m 45s
Merge branch 'pyscf:master' into pm_becke_fix CI #23: Commit cab27bc pushed by jonas-greiner
2h 18m 36s pm_becke_fix
pm_becke_fix
2h 18m 36s
Merge branch 'pyscf:master' into pm_becke_fix Lint #23: Commit cab27bc pushed by jonas-greiner
46s pm_becke_fix
pm_becke_fix
46s
Print imaginary frequency as negative frequency in dump_normal_mode() CI #22: Commit 9e95a66 pushed by jonas-greiner
2h 18m 46s master
master
2h 18m 46s
Print imaginary frequency as negative frequency in dump_normal_mode() Lint #22: Commit 9e95a66 pushed by jonas-greiner
51s master
master
51s
Update pipek.py CI #21: Commit d67e580 pushed by sunqm
2h 19m 58s pm_becke_fix
pm_becke_fix
2h 19m 58s
Update pipek.py Lint #21: Commit d67e580 pushed by sunqm
6m 11s pm_becke_fix
pm_becke_fix
6m 11s
Merge branch 'pm_becke_fix' into fourth_moment CI #20: Commit 234be70 pushed by jonas-greiner
2h 19m 59s fourth_moment
fourth_moment
2h 19m 59s
Merge branch 'pm_becke_fix' into fourth_moment Lint #20: Commit 234be70 pushed by jonas-greiner
57s fourth_moment
fourth_moment
57s
Fix PM tests. CI #19: Commit 30ef90e pushed by jonas-greiner
2h 17m 50s pm_becke_fix
pm_becke_fix
2h 17m 50s
Fix PM tests. Lint #19: Commit 30ef90e pushed by jonas-greiner
1m 2s pm_becke_fix
pm_becke_fix
1m 2s
Merge branch 'pyscf:master' into pm_becke_fix CI #18: Commit 1bbf2ff pushed by jonas-greiner
8m 48s pm_becke_fix
pm_becke_fix
8m 48s
Merge branch 'pyscf:master' into pm_becke_fix Lint #18: Commit 1bbf2ff pushed by jonas-greiner
53s pm_becke_fix
pm_becke_fix
53s
[FEATURE TRANSFER] Transfer MC-PDFT from PySCF-Forge (2/2) (#2908) Lint #17: Commit 0c5aeb1 pushed by jonas-greiner
52s master
master
52s
[FEATURE TRANSFER] Transfer MC-PDFT from PySCF-Forge (2/2) (#2908) CI #17: Commit 0c5aeb1 pushed by jonas-greiner
8m 19s master
master
8m 19s
Merge branch 'pm_becke_fix' into fourth_moment CI #16: Commit d84d917 pushed by jonas-greiner
2h 56m 39s fourth_moment
fourth_moment
2h 56m 39s
Merge branch 'pm_becke_fix' into fourth_moment Lint #16: Commit d84d917 pushed by jonas-greiner
39m 1s fourth_moment
fourth_moment
39m 1s
Removed whitespace. Lint #15: Commit c7582e9 pushed by jonas-greiner
11m 6s pm_becke_fix
pm_becke_fix
11m 6s
Removed whitespace. CI #15: Commit c7582e9 pushed by jonas-greiner
2h 20m 47s pm_becke_fix
pm_becke_fix
2h 20m 47s
Fixed whitespace and indents. Lint #14: Commit c3c3b96 pushed by jonas-greiner
50s fourth_moment
fourth_moment
50s
Fixed whitespace and indents. CI #14: Commit c3c3b96 pushed by jonas-greiner
2h 18m 44s fourth_moment
fourth_moment
2h 18m 44s
Improved performance of PM localization with Becke weights. Lint #13: Commit 692e818 pushed by jonas-greiner
47s pm_becke_fix
pm_becke_fix
47s