qcelemental
QCElemental is a resource module for quantum chemistry containing physical constants and periodic table data from NIST and molecule handlers.
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Summary
QCElemental is a resource module for quantum chemistry containing physical constants and periodic table data from NIST and molecule handlers.
Last Updated
Jan 8, 2026 at 16:28
License
BSD-3-Clause
Total Downloads
0
GitHub Repository
https://github.com/MolSSI/QCElementalDocumentation
https://qcelemental.readthedocs.io/en/latest/