ABINIT is an atomic-scale simulation software suite.

Installers

conda install

  • linux-64  v9.4.2
To install this package with conda run one of the following:
conda install -c conda-forge abinit
conda install -c conda-forge/label/broken abinit

Description

ABINIT is a software suite to calculate the optical, mechanical, vibrational, and other observable properties of materials. Starting from the quantum equations of density functional theory, you can build up to advanced applications with perturbation theories based on DFT, and many-body Green's functions (GW and DMFT) ...


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