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ABINIT 

ABINIT 

Description

ABINIT is a package whose main program allows one to find the total energy, charge density and electronic structure of systems made of electrons and nuclei (molecules and periodic solids) within Density Functional Theory (DFT), using pseudopotentials and a planewave or wavelet basis.

More information

- Homepage: https://www.abinit.org/

Available Versions of ABINIT

Version

Module

Available on

Version

Module

Available on

9.6.2-intel-2021b

chem/ABINIT/9.6.2-intel-2021b

Noctua 2

9.6.2-foss-2022a

chem/ABINIT/9.6.2-foss-2022a

Noctua 2

This table is generated automatically. If you need other versions please click pc2-support@uni-paderborn.de.

Usage Hints for ABINIT

If you need support in using this software or example job scripts please click pc2-support@uni-paderborn.de.

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