Plugin for FermiLib
Switch branches/tags
Nothing to show
Clone or download
Fetching latest commit…
Cannot retrieve the latest commit at this time.
Permalink
Failed to load latest commit information.
examples
fermilibpluginpyscf
.gitignore
LICENSE
MANIFEST.in
NOTICE
README.rst
requirements.txt
setup.py

README.rst

FermiLib Plugin to interface with PySCF

This repository contains a plugin which allows FermiLib (licensed under Apache 2) to interface with the open-source quantum chemistry package PySCF (licensed under BSD-2-Clause).

Installation

To install this plugin, clone this git repo and then change directory to the top level folder. Then, run

python -m pip install -e .

Alternatively, one can install using pip with the command

python -m pip install fermilibpluginpyscf

License

This plugin is released under the Apache 2 license.