ABINIT

Ab initio engines Beyond-DFT with localized orbitals

General information

Code homepage: https://www.abinit.org

Source code: https://github.com/abinit/abinit

Detailed information

Short 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).