EZFF

Python-based library for easy force-field fitting

Installation

Install from PyPI using

python3 -m pip install https://github.com/ppgaluzio/MOBOpt/archive/master.zip
python3 -m pip install EZFF

To get the examples and documentation, install the latest developmental version from GitHub via

git clone https://github.com/arvk/EZFF.git
cd EZFF
python setup.py install

Code documentation and examples can be found at ezff.readthedocs.io

Uses xtal for handling atomic structures and trajectories. Multi-objective optimization is implemented through Platypus.

Name		Name	Last commit message	Last commit date
Latest commit History 260 Commits
docs		docs
examples		examples
ezff		ezff
tests		tests
.gitignore		.gitignore
.readthedocs.yaml		.readthedocs.yaml
.travis.yml		.travis.yml
LICENSE		LICENSE
MANIFEST.in		MANIFEST.in
README.md		README.md
setup.py		setup.py