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@Andrew-S-Rosen Andrew-S-Rosen released this 10 Feb 21:16
· 1089 commits to main since this release
v0.6.5
ae5436a
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Learn about vigilant mode.

[0.6.5]

Added

  • PDOS jobs and flows for Espresso

Changed

  • Modified the Espresso results schema to be DB-compatible
  • The PRIMARY_STORE setting has changed to STORE and is now formatted more intuitively
  • Uses 2024 stable release of black

Fixed

  • Fixed usage of MontyStore as the data store option

Removed

  • Removed the deprecated "q-chem legacy" recipes
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