theochem / PyCI

A flexible ab-initio quantum chemistry library for (parameterized) configuration interaction calculations.
http://pyci.qcdevs.org/
GNU General Public License v3.0
13 stars 9 forks source link

.. : This file is part of PyCI. : : PyCI is free software: you can redistribute it and/or modify it under : the terms of the GNU General Public License as published by the Free : Software Foundation, either version 3 of the License, or (at your : option) any later version. : : PyCI is distributed in the hope that it will be useful, but WITHOUT : ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or : FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License : for more details. : : You should have received a copy of the GNU General Public License : along with PyCI. If not, see http://www.gnu.org/licenses/.

|Python 3|

PyCI

PyCI_ is a flexible quantum chemistry Configuration Interaction library for Python 3.

PyCI is distributed under the GNU General Public License version 3 (GPLv3). See http://www.gnu.org/licenses/ for more information.

See http://pyci.qcdevs.org/ for up-to-date installation and usage instructions, as well as for tutorials and the API reference.

Citing PyCI

See the CONTRIBUTORS file.

.. |Python 3| image:: http://img.shields.io/badge/python-3-blue.svg :target: https://docs.python.org/3.8/