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Bump custodian from 2025.4.14 to 2025.5.12#1243

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Bump custodian from 2025.4.14 to 2025.5.12#1243
github-actions[bot] merged 1 commit intomainfrom
dependabot/pip/custodian-2025.5.12

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@dependabot dependabot bot commented on behalf of github Jul 7, 2025

Bumps custodian from 2025.4.14 to 2025.5.12.

Release notes

Sourced from custodian's releases.

v2025.5.12

See changes at https://materialsproject.github.io/custodian

Changelog

Sourced from custodian's changelog.

2025.5.12

  • PR #355 from @​naik-aakash (#355) updated the list of output files from LOBSTER
  • PR #361 from @​yanghan234 (#361)
    • In finite field calculations, the OUTCAR prints the calculations for all of the requested directions. Updated the codes to parse electronic iterations.
  • PR #375 from @​Andrew-S-Rosen (#375) Closes #374. This PR makes a change to the logic for choosing whether a VASP calculation should be run with the gamma-point only version of VASP (typically vasp_gam) or not. Specifically, we no longer check for whether the KPOINTS file is gamma-centered or not. This is because a 1x1x1 Monkhorst-Pack grid should be the same as a 1x1x1 Gamma-centered grid. An analogous change was made for the KSPACING-related check. The tests have been updated, and two previously missing tests have been added:
    • A test to make sure the standard version of VASP is used when the kpoints are not 1x1x1
    • A test to make sure that the standard version of VASP is used when a small KSPACING is set
  • PR #373 from @​esoteric-ephemera (#373) Adds support for correcting two VASP errors:
    • FEXCF, close #365
    • IBZKPT Also ensure that $\Gamma$-point only VASP isn't run when DFPT calcs are run (either / both LEPSILON or LOPTICS are True)
Commits
  • f677985 Update dev docs
  • b71fc6d Fix release.
  • aef1d35 Updated changelog.
  • dcecbf8 Update lobster output file list (#355)
  • e08e02a fix large sigma handler (#361)
  • 3801ffb Fix custodian.utils.backup when directory keyword argument is set (#379)
  • d82fe4a pre-commit autoupdate (#376)
  • 92cf6ca Add a test to make sure the error.1.tar.gz file is not empty (#377)
  • 543cafb Use vasp_gam for 1x1x1 k-point grids regardless of whether it is gamma-cent...
  • eb222a1 NonConvergingErrorHandler document AMIX maybe ineffective in helping SCF ...
  • Additional commits viewable in compare view

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Bumps [custodian](https://github.com/materialsproject/custodian) from 2025.4.14 to 2025.5.12.
- [Release notes](https://github.com/materialsproject/custodian/releases)
- [Changelog](https://github.com/materialsproject/custodian/blob/master/docs/changelog.md)
- [Commits](materialsproject/custodian@v2025.4.14...v2025.5.12)

---
updated-dependencies:
- dependency-name: custodian
  dependency-version: 2025.5.12
  dependency-type: direct:production
  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 python Pull requests that update python code labels Jul 7, 2025
@github-actions github-actions bot merged commit 0255464 into main Jul 7, 2025
18 of 21 checks passed
@github-actions github-actions bot deleted the dependabot/pip/custodian-2025.5.12 branch July 7, 2025 11:14
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