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Update ORCA to work with ASE v3.23
Build docs #251: Pull request #333 opened by gelzinyte
August 15, 2024 21:51 3m 9s orca-update
August 15, 2024 21:51 3m 9s
more clean up
publish to pypi #104: Commit d360c85 pushed by gelzinyte
August 15, 2024 21:24 24s orca-update
August 15, 2024 21:24 24s
Test for ase fileio caching with VASP example
Build docs #250: Pull request #332 synchronize by JPDarby
August 14, 2024 08:48 3m 6s JPDarby:ase_cache
August 14, 2024 08:48 3m 6s
Test for ase fileio caching with VASP example
Python Package and tests #845: Pull request #332 synchronize by JPDarby
August 14, 2024 08:48 57m 57s JPDarby:ase_cache
August 14, 2024 08:48 57m 57s
Test for ase fileio caching with VASP example
Python Package and tests #844: Pull request #332 synchronize by JPDarby
August 14, 2024 08:33 2m 52s JPDarby:ase_cache
August 14, 2024 08:33 2m 52s
Test for ase fileio caching with VASP example
Build docs #249: Pull request #332 synchronize by JPDarby
August 14, 2024 08:33 4m 8s JPDarby:ase_cache
August 14, 2024 08:33 4m 8s
Test for ase fileio caching with VASP example
Python Package and tests #843: Pull request #332 synchronize by JPDarby
August 13, 2024 17:35 6m 11s JPDarby:ase_cache
August 13, 2024 17:35 6m 11s
Test for ase fileio caching with VASP example
Build docs #248: Pull request #332 synchronize by JPDarby
August 13, 2024 17:35 4m 8s JPDarby:ase_cache
August 13, 2024 17:35 4m 8s
Test for ase fileio caching with VASP example
Python Package and tests #842: Pull request #332 synchronize by JPDarby
August 13, 2024 17:00 2m 54s JPDarby:ase_cache
August 13, 2024 17:00 2m 54s
Test for ase fileio caching with VASP example
Build docs #247: Pull request #332 synchronize by JPDarby
August 13, 2024 17:00 3m 11s JPDarby:ase_cache
August 13, 2024 17:00 3m 11s
Test for ase fileio caching with VASP example
Python Package and tests #841: Pull request #332 synchronize by JPDarby
August 13, 2024 16:50 2m 46s JPDarby:ase_cache
August 13, 2024 16:50 2m 46s
Test for ase fileio caching with VASP example
Build docs #246: Pull request #332 synchronize by JPDarby
August 13, 2024 16:50 3m 0s JPDarby:ase_cache
August 13, 2024 16:50 3m 0s
Test for ase fileio caching with VASP example
Build docs #245: Pull request #332 synchronize by JPDarby
August 13, 2024 15:19 3m 13s JPDarby:ase_cache
August 13, 2024 15:19 3m 13s
Test for ase fileio caching with VASP example
Python Package and tests #840: Pull request #332 synchronize by JPDarby
August 13, 2024 15:19 2m 59s JPDarby:ase_cache
August 13, 2024 15:19 2m 59s
Tweak to complete_pytest.tin parsing of results line
Build docs #244: Commit 403bd0d pushed by bernstei
August 8, 2024 22:10 3m 20s main
August 8, 2024 22:10 3m 20s
Tweak to complete_pytest.tin parsing of results line
publish to pypi #103: Commit 403bd0d pushed by bernstei
August 8, 2024 22:10 21s main
August 8, 2024 22:10 21s
Test for ase fileio caching with VASP example
Python Package and tests #839: Pull request #332 opened by JPDarby
August 8, 2024 14:46 57m 36s JPDarby:ase_cache
August 8, 2024 14:46 57m 36s
Test for ase fileio caching with VASP example
Build docs #243: Pull request #332 opened by JPDarby
August 8, 2024 14:46 3m 21s JPDarby:ase_cache
August 8, 2024 14:46 3m 21s
Castep ase323 update
Python Package and tests #838: Pull request #330 synchronize by gelzinyte
August 5, 2024 08:59 57m 39s castep-ase323-update
August 5, 2024 08:59 57m 39s
Castep ase323 update
Build docs #242: Pull request #330 synchronize by gelzinyte
August 5, 2024 08:59 3m 17s castep-ase323-update
August 5, 2024 08:59 3m 17s
enforce ase v3.23 with castep calculator
publish to pypi #102: Commit e9086df pushed by gelzinyte
August 5, 2024 08:59 21s castep-ase323-update
August 5, 2024 08:59 21s
Castep ase323 update
Python Package and tests #837: Pull request #330 synchronize by gelzinyte
August 5, 2024 08:47 57m 53s castep-ase323-update
August 5, 2024 08:47 57m 53s
Castep ase323 update
Build docs #241: Pull request #330 synchronize by gelzinyte
August 5, 2024 08:47 3m 7s castep-ase323-update
August 5, 2024 08:47 3m 7s
remove extra empty lines
publish to pypi #101: Commit 7c910d7 pushed by gelzinyte
August 5, 2024 08:47 24s castep-ase323-update
August 5, 2024 08:47 24s
Castep ase323 update
Python Package and tests #836: Pull request #330 opened by gelzinyte
August 5, 2024 08:44 57m 31s castep-ase323-update
August 5, 2024 08:44 57m 31s