Metadata-Version: 2.1
Name: nitrogen
Version: 2.2
Summary: A scientific computing package for nuclear motion calculations of small molecules.
Home-page: https://github.com/bchangala/nitrogen
Author: Bryan Changala
Author-email: bryan.changala@cfa.harvard.edu
License: UNKNOWN
Platform: UNKNOWN
Classifier: Programming Language :: Python :: 3
Classifier: License :: OSI Approved :: MIT License
Classifier: Operating System :: OS Independent
Requires-Python: >=3.7.11
Description-Content-Type: text/markdown
License-File: LICENSE
Requires-Dist: numpy (>=1.20.0)
Requires-Dist: scipy (>=1.4.1)
Requires-Dist: matplotlib (<3.3,>=3.1)
Requires-Dist: scikit-image
Requires-Dist: setuptools (>=49)
Requires-Dist: wheel
Requires-Dist: Cython (>=0.29.21)
Requires-Dist: py3nj (==0.1.2)

# nitrogen

NITROGEN is a Python package for nuclear motion calculations and ab initio rovibronic spectroscopy
of small molecules.

It is available from PyPI via `pip install nitrogen`. 
The source repository is [here](https://github.com/bchangala/nitrogen).

Documentation is available on [Read the Docs](https://nitrogen-docs.readthedocs.io).

NITROGEN ver. 2.x is a complete re-write in Python. 
The original C code (ver. 1.x) is available [here](https://www.colorado.edu/nitrogen).

Permanent DOIs are available for citing stable releases:

v.2.1.2 [![DOI](https://zenodo.org/badge/295796633.svg)](https://zenodo.org/badge/latestdoi/295796633)



