patonlab/pyQRC: 1.0.4 ...

Uses cclib to process orca, qchem and gaussian outputs ...

Bibliographic Details
Main Authors: Robert Paton, Shree Sowndarya Santhanalakkshmi Vejaykummar, Guilian Luchini, aligfellow
Format: Software
Language:unknown
Published: Zenodo 2024
Subjects:
Online Access:https://dx.doi.org/10.5281/zenodo.3365476
https://zenodo.org/doi/10.5281/zenodo.3365476
Description
Summary:Uses cclib to process orca, qchem and gaussian outputs ...