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Institute for Advanced Simulation (IAS)

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Chemistry

Available Simulation Software Packages

Simulation Packages

JUQUEEN

JURECA
Abinit

Haekchen

ADF

Haekchen

AMBER

Haekchen

CPMD

Haekchen

Haekchen

CP2K

Haekchen

Haekchen

Dalton
GPAWplanned

Haekchen

Gromacs

Haekchen

Haekchen

LAMMPS

Haekchen

Haekchen

Molpro

Haekchen

NAMD

Haekchen

Haekchen

NWChem

Haekchen

Quantum Espresso

Haekchen

Haekchen

Tremolo
TURBOMOLE

Haekchen

VASP

An overview about all available software packages on JURECA can be found here.

Visualization Software Packages

For related visualization software packages available, please see here.

Contact:  

Supercomputing support team:

Tel. +49 2461 - 61 2828, E-mail: sc@fz-juelich.de


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