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@Andrew-S-Rosen Andrew-S-Rosen released this 15 Nov 23:10
· 1851 commits to main since this release
v0.4.1
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Learn about vigilant mode.

[0.4.1]

Changed

  • Switched to using the PyPi release of NewtonNet (1.1).
  • NewtonNet recipes don't run a Hessian calculation by default unless needed

Fixed

  • Fixed circular import issue when running Q-Chem calculations.

Removed

  • Removed unsupported qchem_internal_relax_job
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