analphipy 0.0.4

Utilities to perform stat mech analysis of pair potentials

analphipy

Utilities to perform metric analysis on fluid pair potentials. The main features of analphipy as follows:

• Pre-defined spherically symmetric potentials

• Simple interface to extended to user defined pair potentials

• Routines to calculate Noro-Frenkel effective parameters.

• Routines to calculate Jensen-Shannon divergence

Overview

analphipy is a python package to calculate metrics for classical models for pair potentials. It provides a simple and extendable api for pair potentials creation. Several routines to calculate metrics are included in the package.

Links

• Github

• Documentation

Examples

See basic usage

Or see the full documentation

License

This is free software. See LICENSE

Contact

The author can be reached at [e-mail].

Credits

This package was created with Cookiecutter and the wpk-nist-gov/cookiecutter-pypackage Project template forked from audreyr/cookiecutter-pypackage.

History

0.0.1 (2021-12-09)

• First release on PyPI.

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