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v0.0.2

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@Andrew-S-Rosen Andrew-S-Rosen released this 16 Feb 02:56
· 2548 commits to main since this release
v0.0.2
d9eac51

What's Changed

Many changes are included in this release. The main ones include:

  • Support for basic xTB, ORCA, Gaussian, and EMT "recipes".
  • Optional on-the-fly Bader analysis when generating VASP task documents.
  • Vastly increased test coverage

Full Changelog: v0.0.1...v0.0.2

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