Becke is a cython implementation of becke weights for numerical integral.
Becke is a cython package with binary distribution on Windows, Linux and MacOS.
- Becke weights for selected atom(s) in molecule
- Becke weights for all atoms in the molecule
Becke is distributed under BSD 3-Clause.
- Installation requirements:
numpy,cython
To install Becke to system:
pip install becke