The official github mirror of the Abinit repository. We welcome bug fixes and improvements. Note that most of the active developments are hosted on our https://gitlab.abinit.org/ server. Before emb…

Occupation matrix control modification VASP

MACE - Fast and accurate machine learning interatomic potentials with higher order equivariant message passing.

LAttice DYnamic tools

Basic script to compute the helicity of crystalline structures

A LaTeX class for producing presentations and slides

🍓 Strawberry Music Player

🍊 Clementine Music Player

A deep learning package for many-body potential energy representation and molecular dynamics

Uniform Manifold Approximation and Projection

Python package to aid materials design and informatics

A Python library to calculate elastic properties of materials.

Jupyter Notebook Crash Coarse for crystallography

Qt interface for agate: https://github.com/piti-diablotin/agate

Site-Occupation Disorder

A Python library for electronic structure pre/post-processing

A python package of utils for DFT, Tight binding, etc.

Open-source software to post-process Abinit (https://www.abinit.org) data and more ! See qAgate (https://github.com/piti-diablotin/qAgate) for more advanced Graphical User Interface

Open-source library for analyzing the results produced by ABINIT

Tomahawk, the multi-source music player

Python Materials Discovery Framework