CASTEP 22.11-foss-2021b

CASTEP is a leading code for calculating the properties of materials from first principles.

Accessing CASTEP 22.11-foss-2021b

To load the module for CASTEP 22.11-foss-2021b please use this command on the BEAR systems (BlueBEAR, BEAR Cloud VMs, and CaStLeS VMs):

module load CASTEP/22.11-foss-2021b

BEAR Apps Version

2021a

More Information

For more information visit the CASTEP website.

Dependencies

This version of CASTEP has a direct dependency on: foss/2021b Perl/5.34.0-GCCcore-11.2.0 Python/3.9.6-GCCcore-11.2.0

Other Versions

These versions of CASTEP are available on the BEAR systems (BlueBEAR, BEAR Cloud VMs, and CaStLeS VMs). These will be retained in accordance with our Applications Support and Retention Policy.

Version BEAR Apps Version
16.1-foss-2019a 2019a
16.1-foss-2018b 2018b

Last modified on 4th January 2023