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 embarking on making significant changes, please contact the Abinit group. Note that questions will NOT be treated on github, please use the ABINIT Forum.
A Python library for electronic structure pre/post-processing
Open-source library for analyzing the results produced by ABINIT
BandUP: Band Unfolding code for Plane-wave based calculations
A toolbox for quickly build inputs and analyze results of DFT codes
Open source graphical interface to various DFT/Quantum chemistry codes
Configuration files to configure/compile Abinit
Interfaces for atomistic simulation codes and workflows
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
A python code to compute the cumulante expansion of the Green's function for photoemission spectroscopy
generates xsf-format files from lobster 3D-wavefunctions files
Qt interface for agate: https://github.com/piti-diablotin/agate
kits for cp2k and abinit
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
Agent skill for ABINIT result analysis, including energies, DOS, bands, and compact reports.
Agent skill for ABINIT workflow setup, convergence checks, restarts, and scheduler scripts.
To associate your repository with the abinit topic, visit your repo's landing page and select "manage topics."