cclib 1.8 released

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Aug 28, 2023, 3:08:08 PM8/28/23
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Hi all,

We have just released version 1.8 of cclib on GitHub and PyPI.

Summary of changes since last version
  • Added Julia language bindings
  • Added parsers for NBO and GAMESS *.dat files
  • New attribute: nmrcouplingtensors for NMR spin-spin couplings
  • New attribute: rotconsts for rotational constants
  • New method: CM5 charges
  • More improvements and fixes than any other release - see the changelog for details
Eric on behalf of cclib devs
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