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Bump shakenbreak from 3.3.1 to 3.3.3 #2155

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merged 18 commits into from
May 24, 2024

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@dependabot dependabot bot commented on behalf of github May 16, 2024

Bumps shakenbreak from 3.3.1 to 3.3.3.

Release notes

Sourced from shakenbreak's releases.

3.3.3

  • Add verbose option to more parsing/plotting functions for better control of output detail.
  • Improve effiency & robustness of oxidation state handling.
  • Miscellaneous efficiency (e.g. memory reduction) and robustness updates.
  • Improved GitHub Actions test efficiency.
Changelog

Sourced from shakenbreak's changelog.

v3.3.3

  • Add verbose option to more parsing/plotting functions for better control of output detail.
  • Improve effiency & robustness of oxidation state handling.
  • Miscellaneous efficiency (e.g. memory reduction) and robustness updates.
  • Improved GitHub Actions test efficiency.

v3.3.2

  • Add verbose options to io.parse_energies() and snb-parse, also used in snb-plot and snb-analyse, and set to False by default to reduce verbosity of certain SnB CLI commands.
  • Use doped functions to make oxi-state guessing (and thus defect initialisation) more efficient.
  • Miscellaneous efficiency and robustness updates.
  • Testing updates.
Commits
  • 739ae96 Merge pull request #71 from SMTG-Bham/develop
  • c30b3bc Bump changelog and version numbers for release
  • 5084535 Merge remote-tracking branch 'origin/develop' into develop
  • 8fcae93 Update paper list
  • 989d603 Missing cd .. call in SnB_run.sh
  • 931be0b Minor formatting and efficiency updates
  • a4cd681 remove uncecessary lines in _format_distortion_names that format names for ...
  • 0067d83 remove redundant lines in io.py
  • d6aea62 Update formatting and linting
  • bbf92e9 Fix typo
  • Additional commits viewable in compare view

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Bumps [shakenbreak](https://github.com/SMTG-Bham/shakenbreak) from 3.3.1 to 3.3.3.
- [Release notes](https://github.com/SMTG-Bham/shakenbreak/releases)
- [Changelog](https://github.com/SMTG-Bham/ShakeNBreak/blob/main/CHANGELOG.rst)
- [Commits](SMTG-Bham/ShakeNBreak@v3.3.1...v3.3.3)

---
updated-dependencies:
- dependency-name: shakenbreak
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <[email protected]>
@dependabot dependabot bot added dependencies Dependency update or issue python Pull requests that update Python code labels May 16, 2024
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Can one of the admins verify this patch?

@Andrew-S-Rosen Andrew-S-Rosen enabled auto-merge (squash) May 16, 2024 01:51
@Andrew-S-Rosen Andrew-S-Rosen changed the title Bump shakenbreak from 3.3.1 to 3.3.3 Bump shakenbreak from 3.3.1 to 3.3.2 May 16, 2024
@Andrew-S-Rosen Andrew-S-Rosen changed the title Bump shakenbreak from 3.3.1 to 3.3.2 Bump shakenbreak from 3.3.1 to 3.3.3 May 16, 2024
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codecov bot commented May 24, 2024

Codecov Report

All modified and coverable lines are covered by tests ✅

Project coverage is 99.04%. Comparing base (e0ec6fd) to head (111f674).

Additional details and impacted files
@@           Coverage Diff           @@
##             main    #2155   +/-   ##
=======================================
  Coverage   99.04%   99.04%           
=======================================
  Files          81       81           
  Lines        3357     3357           
=======================================
  Hits         3325     3325           
  Misses         32       32           

☔ View full report in Codecov by Sentry.
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@Andrew-S-Rosen Andrew-S-Rosen merged commit cbc6bdd into main May 24, 2024
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@Andrew-S-Rosen Andrew-S-Rosen deleted the dependabot/pip/shakenbreak-3.3.3 branch May 24, 2024 18:51
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