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@dependabot dependabot bot commented on behalf of github Dec 29, 2025

Bumps spglib from 2.6.0 to 2.7.0.

Release notes

Sourced from spglib's releases.

Spglib v2.7.0

What's Changed

🛠 Breaking Changes

Other changes

New Contributors

Full Changelog: spglib/spglib@v2.6.0...v2.7.0

Changelog

Sourced from spglib's changelog.

v2.7.0 (27 Dec. 2025)

Main changes

  • [#612](spglib/spglib#612) Improve implementation of #610.

  • [#610](spglib/spglib#610) Try to preserve the Bravais lattice orientation with respect to the input one in magnetic space group when there are symmetrically equivalent candidates. By this transformation_matrix, origin_shift, std_* in SpglibMagneticDataset can be chosen differently.

Python API

  • Switched to using pybind11 for generating the python bindings
  • Added free-threading support using pybind11. Requires pybind11 >= 2.13.
  • Deprecated get_error_message() and error attributes.
  • Python functions can now raise exceptions. To opt-in set spglib.OLD_ERROR_HANLDING=False. For more information see the [documentation page][python-exceptions].

Fortran API

  • Expose spg_get_spacegroup_type_from_symmetry.

Users can now analyse of a set of rotation and translation operations to find the Hall number and spacegroup data.

Commits
  • 12355c7 Release v2.7.0 (#628)
  • 0851d0d Fix heading indentation
  • 12cb435 Release v2.7.0
  • 84693ee Some more doc in python exception (#627)
  • 717cf5e Add a practical example of how to use the exceptions
  • a10bd2b Export OLD_ERROR_HANDLING
  • b9a8726 Drop bogus notes message in get_error_message
  • bfa1c89 Expand the exception handling details in the module docstring
  • 9cdfd1a Update doc following pre-commit
  • b53a1cb Some more doc in python exception
  • Additional commits viewable in compare view

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Bumps [spglib](https://github.com/spglib/spglib) from 2.6.0 to 2.7.0.
- [Release notes](https://github.com/spglib/spglib/releases)
- [Changelog](https://github.com/spglib/spglib/blob/develop/ChangeLog.md)
- [Commits](spglib/spglib@v2.6.0...v2.7.0)

---
updated-dependencies:
- dependency-name: spglib
  dependency-version: 2.7.0
  dependency-type: direct:development
  update-type: version-update:semver-minor
...

Signed-off-by: dependabot[bot] <support@github.com>
@dependabot dependabot bot added dependencies Pull requests that update a dependency file minor add functionality in a backward compatible manner python Pull requests that update python code labels Dec 29, 2025
@dependabot dependabot bot requested a review from jan-janssen as a code owner December 29, 2025 16:06
@dependabot dependabot bot added dependencies Pull requests that update a dependency file minor add functionality in a backward compatible manner python Pull requests that update python code labels Dec 29, 2025
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@jan-janssen jan-janssen marked this pull request as draft December 29, 2025 16:31
@jan-janssen jan-janssen force-pushed the dependabot/pip/spglib-2.7.0 branch from 59851f8 to 2e54606 Compare January 3, 2026 16:55
@jan-janssen jan-janssen marked this pull request as ready for review January 3, 2026 17:00
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codecov bot commented Jan 3, 2026

Codecov Report

❌ Patch coverage is 20.00000% with 4 lines in your changes missing coverage. Please review.
✅ Project coverage is 82.78%. Comparing base (e519853) to head (a6a6688).
⚠️ Report is 7 commits behind head on main.

Files with missing lines Patch % Lines
structuretoolkit/analyse/symmetry.py 20.00% 4 Missing ⚠️
Additional details and impacted files
@@           Coverage Diff           @@
##             main     #439   +/-   ##
=======================================
  Coverage   82.78%   82.78%           
=======================================
  Files          24       24           
  Lines        1807     1807           
=======================================
  Hits         1496     1496           
  Misses        311      311           

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@github-actions github-actions bot merged commit 660834c into main Jan 3, 2026
17 of 18 checks passed
@github-actions github-actions bot deleted the dependabot/pip/spglib-2.7.0 branch January 3, 2026 17:03
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3 participants