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ruff fixes (#894) build-docs #305: Commit 40bfecd pushed by janosh
June 22, 2024 19:16 6m 22s main
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June 22, 2024 19:16 6m 22s
Add test for supercell matrix creation in phonon workflow (#873) build-docs #304: Commit cda583b pushed by JaGeo
June 5, 2024 07:32 6m 3s main
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June 5, 2024 07:32 6m 3s
transpose matrix (#872) build-docs #303: Commit 8016942 pushed by utf
June 4, 2024 16:31 5m 57s main
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June 4, 2024 16:31 5m 57s
Handling failures in elastic flow (#861) build-docs #302: Commit a5e502f pushed by JaGeo
May 29, 2024 15:40 6m 19s main
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May 29, 2024 15:40 6m 19s
Make Fermi Energy Optional for FHI-aims (#793) build-docs #301: Commit c369c86 pushed by JaGeo
May 16, 2024 14:54 5m 49s main
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May 16, 2024 14:54 5m 49s
fix typos build-docs #300: Commit e84f1fa pushed by janosh
May 15, 2024 18:45 6m 3s main
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May 15, 2024 18:45 6m 3s
Fix title hierarchies in VASP documentation (#853) build-docs #299: Commit dd582ff pushed by JaGeo
May 15, 2024 07:53 5m 44s main
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May 15, 2024 07:53 5m 44s
Fix TrajectoryObserver.to_ase_trajectory return type (#852) build-docs #298: Commit 832fdbe pushed by janosh
May 14, 2024 19:01 6m 18s main
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May 14, 2024 19:01 6m 18s
CI add repository_dispatch event for pymatgen_ci_trigger (#835) build-docs #297: Commit 313f809 pushed by janosh
May 11, 2024 22:30 6m 34s main
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May 11, 2024 22:30 6m 34s
Update LobsterPy version (#841) build-docs #296: Commit d22e247 pushed by JaGeo
May 11, 2024 21:40 5m 42s main
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May 11, 2024 21:40 5m 42s
from_... class methods now return typing_extensions.Self (#840) build-docs #295: Commit df7c769 pushed by janosh
May 11, 2024 21:23 5m 34s main
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May 11, 2024 21:23 5m 34s
Add magnetic orderings workflow (#432) build-docs #294: Commit 3b550be pushed by JaGeo
May 11, 2024 21:02 6m 23s main
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May 11, 2024 21:02 6m 23s
Document the option to run LOBSTER with one jobscript only (#811) build-docs #293: Commit 29a5731 pushed by JaGeo
May 11, 2024 20:15 6m 20s main
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May 11, 2024 20:15 6m 20s
clean up test_lobster_task_document build-docs #292: Commit 015987f pushed by janosh
May 11, 2024 19:54 5m 42s main
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May 11, 2024 19:54 5m 42s
Update LobsterTaskDoc (#723) build-docs #291: Commit ae3d0d6 pushed by janosh
May 11, 2024 19:37 5m 57s main
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May 11, 2024 19:37 5m 57s
Turn ForceFieldRelaxMaker._calculator method into calculator prop… build-docs #290: Commit 6b9d8bb pushed by janosh
May 10, 2024 19:30 9m 47s main
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May 10, 2024 19:30 9m 47s
Add missing calculator_kwargs and remove outdated model/`model_kw… build-docs #289: Commit 7e22064 pushed by janosh
May 3, 2024 16:41 7m 53s main
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May 3, 2024 16:41 7m 53s
Add more details to the installation guide (#810) build-docs #288: Commit 974b9cd pushed by janosh
April 26, 2024 03:59 5m 34s main
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April 26, 2024 03:59 5m 34s
Add fix_symmetry: bool = False option to forcefield relax makers (#… build-docs #287: Commit 782abc1 pushed by janosh
April 26, 2024 01:24 5m 59s main
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April 26, 2024 01:24 5m 59s
Simplify phonon get_supercell_size() and test clean up (#783) build-docs #286: Commit e408beb pushed by janosh
April 25, 2024 23:13 6m 25s main
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April 25, 2024 23:13 6m 25s
Remove abinit __all__ module star exports (#804) build-docs #285: Commit f25693d pushed by janosh
April 10, 2024 08:41 5m 52s main
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April 10, 2024 08:41 5m 52s
Abinit workflows: static, non-scf and relaxation. (#183) build-docs #284: Commit f26b43b pushed by utf
April 8, 2024 13:52 6m 24s main
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April 8, 2024 13:52 6m 24s
Bump numpydoc from 1.6.0 to 1.7.0 (#796) build-docs #283: Commit 256b39a pushed by janosh
April 4, 2024 08:53 6m 14s main
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April 4, 2024 08:53 6m 14s
Bump ipython from 8.22.2 to 8.23.0 (#798) build-docs #282: Commit 4e86f58 pushed by janosh
April 4, 2024 08:50 7m 36s main
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April 4, 2024 08:50 7m 36s
Bump phonopy from 2.22.0 to 2.22.1 (#795) build-docs #281: Commit d403233 pushed by janosh
April 4, 2024 08:48 6m 39s main
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April 4, 2024 08:48 6m 39s