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Fix bug in VASP parameter parsing (#3870) Deploy Jekyll with GitHub Pages dependencies preinstalled #418: Commit b0d9946 pushed by mkhorton
June 9, 2024 02:59 1m 17s master
master
June 9, 2024 02:59 1m 17s
Add strict_anions option to MaterialsProject2020Compatibility (#3… Deploy Jekyll with GitHub Pages dependencies preinstalled #417: Commit 85e0f34 pushed by mkhorton
June 9, 2024 02:58 56s master
master
June 9, 2024 02:58 56s
Slightly more robust MSONAtoms handling (#3869) Deploy Jekyll with GitHub Pages dependencies preinstalled #416: Commit 024fce1 pushed by janosh
June 9, 2024 01:22 1m 4s master
master
June 9, 2024 01:22 1m 4s
Simplify case handling in lobster.inputs (#3848) Deploy Jekyll with GitHub Pages dependencies preinstalled #415: Commit f545d58 pushed by janosh
June 8, 2024 15:39 56s master
master
June 8, 2024 15:39 56s
np.newaxis -> None Deploy Jekyll with GitHub Pages dependencies preinstalled #414: Commit 36cde41 pushed by janosh
June 8, 2024 15:13 1m 2s master
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June 8, 2024 15:13 1m 2s
Bug fix: handle non-integer oxidation states in Species (#3868) Deploy Jekyll with GitHub Pages dependencies preinstalled #413: Commit 14988c0 pushed by janosh
June 7, 2024 15:34 57s master
master
June 7, 2024 15:34 57s
Replace hard coded class names, add types for io.vasp.sets (#3863) Deploy Jekyll with GitHub Pages dependencies preinstalled #412: Commit 7c3ef9e pushed by janosh
June 7, 2024 13:02 59s master
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June 7, 2024 13:02 59s
refactor Deploy Jekyll with GitHub Pages dependencies preinstalled #411: Commit 6d45741 pushed by janosh
June 6, 2024 14:19 1m 6s master
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June 6, 2024 14:19 1m 6s
VaspInput document breaking POTCAR->POTCAR.spec rename in #3835 (clos… Deploy Jekyll with GitHub Pages dependencies preinstalled #410: Commit d64dea2 pushed by janosh
June 6, 2024 12:39 1m 5s master
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June 6, 2024 12:39 1m 5s
Add types annotations for core.interface (#3822) Deploy Jekyll with GitHub Pages dependencies preinstalled #409: Commit 65d5379 pushed by janosh
June 6, 2024 11:16 1m 5s master
master
June 6, 2024 11:16 1m 5s
Add property chemical_system_set to Composition and `SiteCollecti… Deploy Jekyll with GitHub Pages dependencies preinstalled #408: Commit 5c7889c pushed by janosh
June 5, 2024 21:34 59s master
master
June 5, 2024 21:34 59s
unpin chgnet==0.3.5, now allow >=0.3.8 Deploy Jekyll with GitHub Pages dependencies preinstalled #407: Commit 74aec89 pushed by janosh
June 5, 2024 17:24 1m 10s master
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June 5, 2024 17:24 1m 10s
v2024.6.4 Deploy Jekyll with GitHub Pages dependencies preinstalled #406: Commit 163cc01 pushed by janosh
June 4, 2024 17:35 2m 21s master
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June 4, 2024 17:35 2m 21s
update tests/files/.pytest-split-durations Deploy Jekyll with GitHub Pages dependencies preinstalled #405: Commit d38aee2 pushed by janosh
June 4, 2024 17:32 1m 7s master
master
June 4, 2024 17:32 1m 7s
Add new .pmgrc.yaml setting PMG_VASP_PSP_SUB_DIRS: dict[str, str]… Deploy Jekyll with GitHub Pages dependencies preinstalled #404: Commit c55e056 pushed by janosh
June 4, 2024 16:19 1m 15s master
master
June 4, 2024 16:19 1m 15s
Clarify argument shift for SlabGenerator.get_slab (#3748) Deploy Jekyll with GitHub Pages dependencies preinstalled #403: Commit eed8403 pushed by janosh
June 3, 2024 20:42 57s master
master
June 3, 2024 20:42 57s
Add CI run without 'optional' deps installed (#3857) Deploy Jekyll with GitHub Pages dependencies preinstalled #402: Commit d1fac20 pushed by janosh
June 3, 2024 19:14 54s master
master
June 3, 2024 19:14 54s
Fix filter condition for warn msg of unphysical site occupancy in `io… Deploy Jekyll with GitHub Pages dependencies preinstalled #401: Commit 1a5af18 pushed by janosh
June 3, 2024 16:22 1m 3s master
master
June 3, 2024 16:22 1m 3s
Run CI with two different uv resolution strategies: highest and `… Deploy Jekyll with GitHub Pages dependencies preinstalled #400: Commit eccf075 pushed by janosh
June 3, 2024 16:09 1m 4s master
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June 3, 2024 16:09 1m 4s
v2024.5.31 Deploy Jekyll with GitHub Pages dependencies preinstalled #399: Commit 2982968 pushed by janosh
May 31, 2024 19:13 1m 41s master
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May 31, 2024 19:13 1m 41s
Add type annotations for io.vasp.outputs (#3776) Deploy Jekyll with GitHub Pages dependencies preinstalled #398: Commit c70e5b8 pushed by shyuep
May 31, 2024 19:06 2m 20s master
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May 31, 2024 19:06 2m 20s
Update reqs. Deploy Jekyll with GitHub Pages dependencies preinstalled #397: Commit cd8846b pushed by shyuep
May 31, 2024 19:05 1m 3s master
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May 31, 2024 19:05 1m 3s
[Deprecation] Replace Element property is_rare_earth_metal with `… Deploy Jekyll with GitHub Pages dependencies preinstalled #396: Commit f214a5c pushed by shyuep
May 30, 2024 19:55 1m 0s master
master
May 30, 2024 19:55 1m 0s
Improve unphysical (greater than 1) occupancy handling in CifParser… Deploy Jekyll with GitHub Pages dependencies preinstalled #395: Commit a772ddb pushed by shyuep
May 30, 2024 19:34 17m 7s master
master
May 30, 2024 19:34 17m 7s
Use isclose over == for overlap position check in `SlabGenerator.… Deploy Jekyll with GitHub Pages dependencies preinstalled #394: Commit 0c9ff40 pushed by shyuep
May 30, 2024 19:33 55s master
master
May 30, 2024 19:33 55s