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Make sure the last step is written when using dE_S0S1
GFortran CI #1060: Pull request #184 synchronize by danielhollas
November 6, 2024 19:42 2m 54s fix-s1s0-check
November 6, 2024 19:42 2m 54s
Orca interface cleanup
GFortran CI #1059: Pull request #181 synchronize by danielhollas
November 5, 2024 19:01 9m 2s orca-interface-cleanup
November 5, 2024 19:01 9m 2s
DFTB+ interface upgrade (#179)
GFortran CI #1058: Commit 3c61708 pushed by danielhollas
November 5, 2024 18:52 11m 31s master
November 5, 2024 18:52 11m 31s
Make sure the last step is written when using dE_S0S1
GFortran CI #1057: Pull request #184 synchronize by danielhollas
November 4, 2024 19:02 9m 9s fix-s1s0-check
November 4, 2024 19:02 9m 9s
Make sure the last step is written when using dE_S0S1
GFortran CI #1056: Pull request #184 opened by danielhollas
November 4, 2024 18:55 11m 9s fix-s1s0-check
November 4, 2024 18:55 11m 9s
DFTB+ interface upgrade
GFortran CI #1055: Pull request #179 synchronize by danielhollas
October 28, 2024 14:58 3m 37s dftb-interface-cleanup
October 28, 2024 14:58 3m 37s
CI: Switch intel build to ifx (#183)
GFortran CI #1054: Commit 7ab1dd6 pushed by danielhollas
October 26, 2024 22:14 9m 1s master
October 26, 2024 22:14 9m 1s
Disable spline potential (#182)
GFortran CI #1053: Commit 6d01fab pushed by danielhollas
October 26, 2024 22:11 11m 8s master
October 26, 2024 22:11 11m 8s
CI: Switch intel build to ifx
GFortran CI #1052: Pull request #183 synchronize by danielhollas
October 24, 2024 17:42 3m 13s ci-setup-fortran
October 24, 2024 17:42 3m 13s
CI: Switch intel build to ifx
GFortran CI #1051: Pull request #183 synchronize by danielhollas
October 24, 2024 17:32 3m 53s ci-setup-fortran
October 24, 2024 17:32 3m 53s
Disable spline potential
GFortran CI #1050: Pull request #182 synchronize by danielhollas
October 24, 2024 17:12 11m 14s remove-splines
October 24, 2024 17:12 11m 14s
CI: Switch intel build to ifx
GFortran CI #1049: Pull request #183 synchronize by danielhollas
October 24, 2024 16:56 9m 14s ci-setup-fortran
October 24, 2024 16:56 9m 14s
Disable spline potential
GFortran CI #1048: Pull request #182 synchronize by danielhollas
October 24, 2024 16:53 3m 23s remove-splines
October 24, 2024 16:53 3m 23s
CI: Switch intel build to ifx
GFortran CI #1047: Pull request #183 opened by danielhollas
October 24, 2024 16:52 11m 7s ci-setup-fortran
October 24, 2024 16:52 11m 7s
Disable spline potential
GFortran CI #1046: Pull request #182 synchronize by danielhollas
October 24, 2024 16:36 3m 28s remove-splines
October 24, 2024 16:36 3m 28s
Disable spline potential
GFortran CI #1045: Pull request #182 opened by danielhollas
October 24, 2024 16:31 2m 34s remove-splines
October 24, 2024 16:31 2m 34s
Orca interface cleanup
GFortran CI #1044: Pull request #181 opened by danielhollas
October 24, 2024 16:16 11m 33s orca-interface-cleanup
October 24, 2024 16:16 11m 33s
DFTB+ interface upgrade
GFortran CI #1043: Pull request #179 synchronize by danielhollas
October 16, 2024 18:32 3m 39s dftb-interface-cleanup
October 16, 2024 18:32 3m 39s
DFTB+ interface upgrade
GFortran CI #1042: Pull request #179 synchronize by danielhollas
October 16, 2024 18:23 4m 36s dftb-interface-cleanup
October 16, 2024 18:23 4m 36s
DFTB+ interface upgrade
GFortran CI #1041: Pull request #179 synchronize by danielhollas
October 16, 2024 15:58 2m 24s dftb-interface-cleanup
October 16, 2024 15:58 2m 24s
DFTB+ interface upgrade
GFortran CI #1040: Pull request #179 synchronize by danielhollas
October 16, 2024 15:25 4m 28s dftb-interface-cleanup
October 16, 2024 15:25 4m 28s
DFTB+ interface upgrade
GFortran CI #1039: Pull request #179 synchronize by danielhollas
October 15, 2024 13:53 3m 22s dftb-interface-cleanup
October 15, 2024 13:53 3m 22s
DFTB+ interface upgrade
GFortran CI #1038: Pull request #179 synchronize by danielhollas
October 15, 2024 12:32 3m 45s dftb-interface-cleanup
October 15, 2024 12:32 3m 45s
DFTB+ interface upgrade
GFortran CI #1037: Pull request #179 synchronize by danielhollas
October 15, 2024 12:21 11m 34s dftb-interface-cleanup
October 15, 2024 12:21 11m 34s
formatter: Add inline python requirements ala PEP 722 (#180)
GFortran CI #1036: Commit 0a5d9f3 pushed by danielhollas
August 22, 2024 13:11 11m 21s master
August 22, 2024 13:11 11m 21s