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- Add dynamic extraction of units install-and-test-workflow #1077: Commit fb4d188 pushed by ndaelman-hu
June 20, 2024 18:19 10m 18s 229-problematic-frequency-parsing-from-gaussian-files
229-problematic-frequency-parsing-from-gaussian-files
June 20, 2024 18:19 10m 18s
OpenMX: parse stress tensor install-and-test-workflow #1076: Commit ee669e6 pushed by ondracka
June 20, 2024 14:57 9m 23s openmx_stress
openmx_stress
June 20, 2024 14:57 9m 23s
Deleted tests for Wannier90 install-and-test-workflow #1075: Commit 847f5c3 pushed by JosePizarro3
June 18, 2024 11:12 6m 17s test_wannier90_basesections
test_wannier90_basesections
June 18, 2024 11:12 6m 17s
Update MANIFEST.in (#230) install-and-test-workflow #1074: Commit b3c3d74 pushed by blueraft
June 11, 2024 12:05 10m 17s develop
develop
June 11, 2024 12:05 10m 17s
Update MANIFEST.in install-and-test-workflow #1073: Commit 4c768ec pushed by blueraft
June 11, 2024 11:19 10m 11s manifest-change
manifest-change
June 11, 2024 11:19 10m 11s
Patching w2dynamics parser copy-pasting the wannier90 textparsers install-and-test-workflow #1072: Commit 8c26d4e pushed by JosePizarro3
May 30, 2024 12:20 6m 18s test_wannier90_basesections
test_wannier90_basesections
May 30, 2024 12:20 6m 18s
- Add checkpoint basis set names to basis_set_map (#226) install-and-test-workflow #1071: Commit e7d1ffe pushed by ndaelman-hu
May 29, 2024 20:19 9m 40s develop
develop
May 29, 2024 20:19 9m 40s
- Add checkpoint basis set names to basis_set_map install-and-test-workflow #1070: Commit cf1ca8f pushed by ndaelman-hu
May 29, 2024 19:21 10m 21s gauss_chkpnt
gauss_chkpnt
May 29, 2024 19:21 10m 21s
- Merge branch 'develop' of https://github.com/nomad-coe/electronic-p… install-and-test-workflow #1069: Commit ff479ec pushed by ndaelman-hu
May 29, 2024 18:50 10m 16s gauss_chkpnt_bs
gauss_chkpnt_bs
May 29, 2024 18:50 10m 16s
install-and-test-workflow install-and-test-workflow #1068: by ndaelman-hu
May 29, 2024 18:34 9m 39s gauss_chkpnt_bs
gauss_chkpnt_bs
May 29, 2024 18:34 9m 39s
Fix gaussian basis set (#223) install-and-test-workflow #1067: Commit 1adcdff pushed by ndaelman-hu
May 29, 2024 12:26 10m 24s develop
develop
May 29, 2024 12:26 10m 24s
- Fix mypy error install-and-test-workflow #1066: Commit 87afb02 pushed by ndaelman-hu
May 29, 2024 12:07 10m 27s fix-guassian
fix-guassian
May 29, 2024 12:07 10m 27s
Relocate basis set default: install-and-test-workflow #1065: Commit 8331c62 pushed by ndaelman-hu
May 29, 2024 11:45 9m 21s fix-guassian
fix-guassian
May 29, 2024 11:45 9m 21s
- Move default out of function install-and-test-workflow #1064: Commit 684c1f3 pushed by ndaelman-hu
May 29, 2024 11:22 9m 17s fix-guassian
fix-guassian
May 29, 2024 11:22 9m 17s
Linting fix install-and-test-workflow #1063: Commit 41e6112 pushed by ladinesa
May 29, 2024 10:53 9m 45s fix-gaussian
fix-gaussian
May 29, 2024 10:53 9m 45s
Fix test install-and-test-workflow #1062: Commit 8d2be16 pushed by ladinesa
May 29, 2024 10:31 9m 13s fix-gaussian
fix-gaussian
May 29, 2024 10:31 9m 13s
Remove constraint on basis set length install-and-test-workflow #1061: Commit c8fb6e1 pushed by ndaelman-hu
May 28, 2024 17:58 9m 56s fix-guassian
fix-guassian
May 28, 2024 17:58 9m 56s
- Add default for basis set (when not mentioned) install-and-test-workflow #1060: Commit 7dcd3f2 pushed by ndaelman-hu
May 28, 2024 17:23 9m 45s fix-guassian
fix-guassian
May 28, 2024 17:23 9m 45s
Fix vasp (#224) install-and-test-workflow #1059: Commit 3b16b4b pushed by ladinesa
May 27, 2024 23:54 9m 28s develop
develop
May 27, 2024 23:54 9m 28s
Fix vasp install-and-test-workflow #1058: Commit 0a7bb95 pushed by ladinesa
May 27, 2024 23:41 9m 27s fix-vasp
fix-vasp
May 27, 2024 23:41 9m 27s
Fix gaussian basis set install-and-test-workflow #1057: Commit ba6c7cb pushed by ladinesa
May 27, 2024 20:46 9m 58s fix-guassian
fix-guassian
May 27, 2024 20:46 9m 58s
Fix regex in cp2k (#222) install-and-test-workflow #1056: Commit 76bad16 pushed by ladinesa
May 27, 2024 08:52 9m 19s develop
develop
May 27, 2024 08:52 9m 19s
Fix regex in cp2k install-and-test-workflow #1055: Commit 8293681 pushed by ladinesa
May 24, 2024 16:31 2m 44s fix-cp2k
fix-cp2k
May 24, 2024 16:31 2m 44s
Fix typo (#221) install-and-test-workflow #1054: Commit bbd8cd1 pushed by TLCFEM
May 24, 2024 00:23 9m 19s develop
develop
May 24, 2024 00:23 9m 19s
np deprecates truth value of np arrays (#220) install-and-test-workflow #1053: Commit 28dee53 pushed by blueraft
May 23, 2024 12:30 10m 8s develop
develop
May 23, 2024 12:30 10m 8s