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Ran 12 Aug 2024 05:24PM UTC

Files 21

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Committed 12 Aug 2024 05:23PM UTC coverage: 95.527% (+0.4%) from 95.082%

Job # 10356462925.2

Build Type

push

github

Committed by

web-flow

Commit Message

customizable chunk size (#122)

* set chunk size when writing a file.

* [pre-commit.ci] auto fixes from pre-commit.com hooks

for more information, see https://pre-commit.ci

* only set first dimension chunk size

* add `use_ase_calc`

* tests `use_ase_calc` read and write

* [pre-commit.ci] auto fixes from pre-commit.com hooks

for more information, see https://pre-commit.ci

* typos

* silence C901

* test converting an extxzy file from ase.io

* [pre-commit.ci] auto fixes from pre-commit.com hooks

for more information, see https://pre-commit.ci

* bump minimal ase version

* Fixes a bug where scalar properties were saved as 1d arrays (#126)

* Fixes a bug where scalar properties where saved as 1d arrays

* [pre-commit.ci] auto fixes from pre-commit.com hooks

for more information, see https://pre-commit.ci

* Add tests for saving scalar props

---------

Co-authored-by: pre-commit-ci[bot] <66853113+pre-commit-ci[bot]@users.noreply.github.com>

---------

Co-authored-by: pre-commit-ci[bot] <66853113+pre-commit-ci[bot]@users.noreply.github.com>
Co-authored-by: Rokas Elijosius <44035332+RokasEl@users.noreply.github.com>

Coverage Stats

1260 of 1319 relevant lines covered (95.53%)

0.96 hits per line

zincware / ZnH5MD / 10356462925 / 2
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main: 95%

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main: 95%

README BADGES
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