vasp: VASP: Vienna Ab-initio Simulation Package

Contents

1. Overview of package
2. Overview of package
   1. General usage
3. Availability of package by cluster

Overview of package

General usage information

VASP (Vienna Ab-initio Simulation Package) is a simulation package to model atomic scale materials from first principles.

The vasp command has been added to your PATH.

**************************************************** NOTE **************************************************** This is restrictively licensed software and is NOT available to all users of the cluster. If you get an error after doing a module load of this package, you are NOT on the list of authorized users. If you or your research group have a license and wish to use this software, have the license holder contact hpcc-help@umd.edu to discussing adding you to the list of authorized users.

Available versions of the package vasp, by cluster

This section lists the available versions of the package vaspon the different clusters.

Available versions of vasp on the Deepthought2 cluster (RHEL8)

Available versions of vasp on the Juggernaut cluster