cclib 1.8.1 released

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Mar 19, 2024, 10:51:34 PM3/19/24

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Hi all,

We have just released version 1.8.1 of cclib on GitHub and PyPI.

Summary of changes since last version

New parser: xTB
Support parsing number of CPUs and memory used for Gaussian, ORCA, and Turbomole
New attributes for the NBO parser
Tested support for Python 3.8 through 3.11
Many developer-facing improvement and several fixes, see changelog for details