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SLME Bug Fixes (#4082)
Deploy Jekyll with GitHub Pages dependencies preinstalled #626: Commit fa62ff4 pushed by mkhorton
September 27, 2024 02:17 1m 9s master
September 27, 2024 02:17 1m 9s
Return bool instead of np.bool_ (#4074)
Deploy Jekyll with GitHub Pages dependencies preinstalled #625: Commit e9ea813 pushed by mkhorton
September 24, 2024 22:14 1m 7s master
September 24, 2024 22:14 1m 7s
Update addons.md (#4069)
Deploy Jekyll with GitHub Pages dependencies preinstalled #624: Commit ea7c339 pushed by shyuep
September 18, 2024 01:13 10m 51s master
September 18, 2024 01:13 10m 51s
Fix: fixed electronic step check with algo = exact and nelm = 1 (#4071)
Deploy Jekyll with GitHub Pages dependencies preinstalled #623: Commit 67e65fd pushed by shyuep
September 18, 2024 01:12 33s master
September 18, 2024 01:12 33s
Update docs
Deploy Jekyll with GitHub Pages dependencies preinstalled #622: Commit 25efe6f pushed by shyuep
September 18, 2024 01:11 9m 3s master
September 18, 2024 01:11 9m 3s
fix chempot_diagram (#4072)
Deploy Jekyll with GitHub Pages dependencies preinstalled #621: Commit d6204d9 pushed by shyuep
September 18, 2024 01:08 1m 5s master
September 18, 2024 01:08 1m 5s
Update docs
Deploy Jekyll with GitHub Pages dependencies preinstalled #620: Commit 150f816 pushed by shyuep
September 17, 2024 03:19 1m 15s master
September 17, 2024 03:19 1m 15s
Updated changelog.
Deploy Jekyll with GitHub Pages dependencies preinstalled #619: Commit b373410 pushed by shyuep
September 17, 2024 03:17 56s master
September 17, 2024 03:17 56s
fix phase diagram break from 41e6d99 (#4070)
Deploy Jekyll with GitHub Pages dependencies preinstalled #618: Commit 96b3284 pushed by shyuep
September 17, 2024 03:09 1m 8s master
September 17, 2024 03:09 1m 8s
improve and test PmgVaspPspDirError msg in PotcarSingle.from_symbol_a…
Deploy Jekyll with GitHub Pages dependencies preinstalled #617: Commit ebfc7a0 pushed by janosh
September 15, 2024 23:48 1m 2s master
September 15, 2024 23:48 1m 2s
Fix all ruff DOC202 (#4067)
Deploy Jekyll with GitHub Pages dependencies preinstalled #616: Commit 60464fd pushed by janosh
September 13, 2024 18:06 1m 10s master
September 13, 2024 18:06 1m 10s
(Not) Use setup-uv in CI tests workflow (#4063)
Deploy Jekyll with GitHub Pages dependencies preinstalled #615: Commit 7743ac7 pushed by janosh
September 13, 2024 10:58 1m 1s master
September 13, 2024 10:58 1m 1s
Fix lll_reduce for slab generation (#3927)
Deploy Jekyll with GitHub Pages dependencies preinstalled #614: Commit 6bb2938 pushed by janosh
September 11, 2024 12:52 1m 24s master
September 11, 2024 12:52 1m 24s
Use distinct names for artifacts (#4059)
Deploy Jekyll with GitHub Pages dependencies preinstalled #613: Commit 1ff1ba5 pushed by janosh
September 10, 2024 17:50 4m 53s master
September 10, 2024 17:50 4m 53s
fix cibuildwheel: No build identifiers selected: BuildSelector(build_…
Deploy Jekyll with GitHub Pages dependencies preinstalled #612: Commit 48e7c98 pushed by janosh
September 10, 2024 14:05 3m 21s master
September 10, 2024 14:05 3m 21s
v2024.9.10
Deploy Jekyll with GitHub Pages dependencies preinstalled #611: Commit 6012a68 pushed by janosh
September 10, 2024 13:13 1m 9s master
September 10, 2024 13:13 1m 9s
Fix apply_operation(fractional=True) (#4057)
Deploy Jekyll with GitHub Pages dependencies preinstalled #610: Commit ed4de1d pushed by janosh
September 9, 2024 22:01 1m 17s master
September 9, 2024 22:01 1m 17s
Fix typo in Cp2kOutput.parse_hirshfeld `add_site_property("hirshf[i…
Deploy Jekyll with GitHub Pages dependencies preinstalled #609: Commit dc6a292 pushed by janosh
September 8, 2024 21:37 58s master
September 8, 2024 21:37 58s
Fix ruff PLC0206 and PLR6104 (#4035)
Deploy Jekyll with GitHub Pages dependencies preinstalled #608: Commit f6b4073 pushed by janosh
September 8, 2024 20:37 1m 4s master
September 8, 2024 20:37 1m 4s
Avoid importing namespace package pymatgen directly (#4053)
Deploy Jekyll with GitHub Pages dependencies preinstalled #607: Commit 13182c5 pushed by janosh
September 8, 2024 15:49 1m 3s master
September 8, 2024 15:49 1m 3s
Make AimsSpeciesFile a dataclass (#4054)
Deploy Jekyll with GitHub Pages dependencies preinstalled #606: Commit 326beb9 pushed by janosh
September 8, 2024 14:23 1m 2s master
September 8, 2024 14:23 1m 2s
fix typos in AimsSpeciesFile and AimsOutCalcChunk
Deploy Jekyll with GitHub Pages dependencies preinstalled #605: Commit 149e115 pushed by janosh
September 7, 2024 20:49 1m 7s master
September 7, 2024 20:49 1m 7s
Add modification to aims input to match atomate2 magnetic order scrip…
Deploy Jekyll with GitHub Pages dependencies preinstalled #604: Commit 05c2e99 pushed by mkhorton
September 7, 2024 20:41 57s master
September 7, 2024 20:41 57s
Fix in-place VaspInput.incar updates having no effect if incar is…
Deploy Jekyll with GitHub Pages dependencies preinstalled #603: Commit 8657780 pushed by janosh
September 7, 2024 14:38 1m 8s master
September 7, 2024 14:38 1m 8s
breaking: pascal case PMG_VASP_PSP_DIR_Error (#4048)
Deploy Jekyll with GitHub Pages dependencies preinstalled #602: Commit 15dc137 pushed by janosh
September 6, 2024 22:39 55s master
September 6, 2024 22:39 55s