cclib 1.7.2 released

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Karol Langner

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Jul 30, 2022, 7:55:06 PM7/30/22
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Hi all,

About a week ago we released version 1.7.2 of cclib, on GitHub and PyPI. 

Summary of change since last version
  • Support for excited states, vibrational frequency and thermochemistry for NWChem
  • Better metadata support for point group detection
  • Several other improvements and fixes, see changelog for details

Karol on behalf of cclib devs
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