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Author:
Paton Research Group
License:
MIT
Summary:
A python program to compute corrections to thermochemical data from frequency calculations
Latest version:
4.4.0
Required dependencies:
numpy
|
pymsym
|
rich
Optional dependencies:
ase
|
matplotlib
|
pandas
|
pyarrow
|
pytest
|
pytest-cov
|
pyyaml
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