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Bump cclib from 1.8 to 1.8.1 #788

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Mar 25, 2024
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@dependabot dependabot bot commented on behalf of github Mar 25, 2024

Bumps cclib from 1.8 to 1.8.1.

Release notes

Sourced from cclib's releases.

cclib-v1.8.1

Summary of changes since last version

  • New parser: xTB
  • Support parsing number of CPUs and memory used for Gaussian, ORCA, and Turbomole
  • New attributes for the NBO parser
  • Tested support for Python 3.8 through 3.11
  • Many developer-facing improvement and several fixes, see changelog for details

cclib-v1.8.1rc2

No release notes provided.

cclib-v1.8.1rc1

No release notes provided.

Commits
  • 07260dd Merge pull request #1387 from berquist/changelog-1.8.1
  • 021c1c3 README for documentation helpers
  • d197c8e Fix Sphinx unformatted text in milestone_issues_and_prs.py helper
  • c5ea231 Update CHANGELOG
  • 529aea2 Merge pull request #1382 from berquist/fix-dependencies
  • 8babb63 move pyquante2 to requirements-dev.txt so at least it can be tracked
  • 150dfcf theochem/iodata is on PyPI with the required minimum version
  • 763c7b3 Merge pull request #1355 from berquist/555-developer-guidelines
  • 4e50439 mocoefs -> mocoeffs
  • 4ae2c59 docs: start section on adding new regression tests
  • Additional commits viewable in compare view

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Bumps [cclib](https://github.com/cclib/cclib) from 1.8 to 1.8.1.
- [Release notes](https://github.com/cclib/cclib/releases)
- [Commits](cclib/cclib@v1.8...v1.8.1)

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

Signed-off-by: dependabot[bot] <[email protected]>
@dependabot dependabot bot added the dependencies Pull requests that update a dependency file label Mar 25, 2024
@github-actions github-actions bot merged commit 4cc71d2 into main Mar 25, 2024
6 checks passed
@github-actions github-actions bot deleted the dependabot/pip/cclib-1.8.1 branch March 25, 2024 07:39
hrushikesh-s pushed a commit to hrushikesh-s/atomate2 that referenced this pull request Jun 28, 2024
Bumps [cclib](https://github.com/cclib/cclib) from 1.8 to 1.8.1.
- [Release notes](https://github.com/cclib/cclib/releases)
- [Commits](cclib/cclib@v1.8...v1.8.1)

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

Signed-off-by: dependabot[bot] <[email protected]>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
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