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Enhancements and bug fixes for thermochemistry
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@paulsaxe paulsaxe released this 05 Oct 13:37
· 4 commits to main since this release
2024.10.5
b65c17d
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Learn about vigilant mode.
  • Improved GUI for thermochemistry so that it automatically recognizes whether it is after e.g. an optimization and configures appropriately.
  • Fixed and issue with transferring the multipole moments to the JSON file
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