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merge master to devel (v0.2.21) (#730)
Publish Python distributions to PyPI #372: Commit 395328a pushed by njzjz
September 20, 2024 18:31 32s devel
September 20, 2024 18:31 32s
v0.2.21 (#729)
Publish Python distributions to PyPI #371: Commit 6387419 pushed by njzjz
September 20, 2024 18:24 43s v0.2.21
September 20, 2024 18:24 43s
v0.2.21 (#729)
Publish Python distributions to PyPI #370: Commit 6387419 pushed by njzjz
September 20, 2024 18:23 34s master
September 20, 2024 18:23 34s
feat: support spin for ABACUS (#718)
Publish Python distributions to PyPI #369: Commit c1d6c73 pushed by wanghan-iapcm
September 20, 2024 07:50 31s devel
September 20, 2024 07:50 31s
Fix: qe/pw/scf unit conversion is not consistent with dpdata (#725)
Publish Python distributions to PyPI #368: Commit 482775f pushed by wanghan-iapcm
September 20, 2024 01:27 2m 36s devel
September 20, 2024 01:27 2m 36s
fix: qe input blocks not seperated by empty lines (#724)
Publish Python distributions to PyPI #367: Commit 2648d50 pushed by wanghan-iapcm
September 20, 2024 00:29 38s devel
September 20, 2024 00:29 38s
feat: support data type dumped to a different name (#727)
Publish Python distributions to PyPI #366: Commit a2fbdd8 pushed by wanghan-iapcm
September 20, 2024 00:29 39s devel
September 20, 2024 00:29 39s
[pre-commit.ci] pre-commit autoupdate (#722)
Publish Python distributions to PyPI #365: Commit 480242e pushed by wanghan-iapcm
September 18, 2024 00:35 7m 45s devel
September 18, 2024 00:35 7m 45s
[pre-commit.ci] pre-commit autoupdate
Publish Python distributions to PyPI #364: Commit beaed14 pushed by pre-commit-ci bot
September 16, 2024 21:58 38s pre-commit-ci-update-config
September 16, 2024 21:58 38s
Feat: Support specifying proportion of atoms to be perturbed in Syste…
Publish Python distributions to PyPI #363: Commit fb942bb pushed by wanghan-iapcm
September 11, 2024 03:39 1h 10m 17s devel
September 11, 2024 03:39 1h 10m 17s
[pre-commit.ci] pre-commit autoupdate (#720)
Publish Python distributions to PyPI #362: Commit 1de5ace pushed by wanghan-iapcm
September 10, 2024 07:22 1m 17s devel
September 10, 2024 07:22 1m 17s
[pre-commit.ci] pre-commit autoupdate
Publish Python distributions to PyPI #361: Commit 9e42812 pushed by pre-commit-ci bot
September 9, 2024 21:57 32s pre-commit-ci-update-config
September 9, 2024 21:57 32s
Update ase.py: To avoid errors in writing to the .extxyz format from …
Publish Python distributions to PyPI #360: Commit 976cf16 pushed by njzjz
September 4, 2024 13:49 40s devel
September 4, 2024 13:49 40s
docs: fix directives (#715)
Publish Python distributions to PyPI #359: Commit e393a8c pushed by wanghan-iapcm
September 4, 2024 00:15 34s devel
September 4, 2024 00:15 34s
merge master to devel (v0.2.20) (#714)
Publish Python distributions to PyPI #358: Commit a78f19e pushed by njzjz
September 3, 2024 03:48 2m 8s devel
September 3, 2024 03:48 2m 8s
v0.2.20 (#713)
Publish Python distributions to PyPI #357: Commit c685e62 pushed by njzjz
September 3, 2024 03:38 3m 0s v0.2.20
September 3, 2024 03:38 3m 0s
v0.2.20 (#713)
Publish Python distributions to PyPI #356: Commit c685e62 pushed by njzjz
September 3, 2024 03:38 2m 34s master
September 3, 2024 03:38 2m 34s
[pre-commit.ci] pre-commit autoupdate (#712)
Publish Python distributions to PyPI #355: Commit bad0285 pushed by wanghan-iapcm
September 3, 2024 03:00 38s devel
September 3, 2024 03:00 38s
fix: only apply comp_prec for floating dtypes (#711)
Publish Python distributions to PyPI #354: Commit c311d16 pushed by wanghan-iapcm
September 3, 2024 02:59 32s devel
September 3, 2024 02:59 32s
feat: file object passed to open (#709)
Publish Python distributions to PyPI #353: Commit 6bf41e3 pushed by wanghan-iapcm
September 3, 2024 02:58 31s devel
September 3, 2024 02:58 31s
fix: fix a typo in #702 (#710)
Publish Python distributions to PyPI #352: Commit 5df6acd pushed by wanghan-iapcm
September 3, 2024 02:18 35s devel
September 3, 2024 02:18 35s
[pre-commit.ci] pre-commit autoupdate
Publish Python distributions to PyPI #351: Commit 9f4e4c0 pushed by pre-commit-ci bot
September 2, 2024 21:48 33s pre-commit-ci-update-config
September 2, 2024 21:48 33s
docs: reformat README and documentation (#707)
Publish Python distributions to PyPI #350: Commit f4d0adf pushed by wanghan-iapcm
August 31, 2024 12:45 34s devel
August 31, 2024 12:45 34s
fix: reuse regular methods for deepmd/mixed (#704)
Publish Python distributions to PyPI #349: Commit 35fdbb8 pushed by wanghan-iapcm
August 31, 2024 11:59 31s devel
August 31, 2024 11:59 31s
Merge branch 'devel' into mixed
Publish Python distributions to PyPI #348: Commit d35743f pushed by wanghan-iapcm
August 31, 2024 10:39 28s mixed
August 31, 2024 10:39 28s