tblite 0.3.0-foss-2023a

The tblite project aims to provide an efficent and uniform interface to the (extended) tight-binding Hamiltonians.

Accessing tblite 0.3.0-foss-2023a

To load the module for tblite 0.3.0-foss-2023a please use this command on the BEAR systems (BlueBEAR and BEAR Cloud VMs):

📋 module load bear-apps/2023a
module load tblite/0.3.0-foss-2023a

BEAR Apps Version

2023a

Architectures

EL8-cascadelake — EL8-icelake — EL8-sapphirerapids

The listed architectures consist of two part: OS-CPU. The OS used is represented by EL and there are several different processor (CPU) types available on BlueBEAR. More information about the processor types on BlueBEAR is available on the BlueBEAR Job Submission page.

More Information

For more information visit the tblite website.

Dependencies

This version of tblite has a direct dependency on: dftd4/3.7.0-foss-2023a foss/2023a mctc-lib/0.3.1-GCC-12.3.0 mstore/0.3.0-GCC-12.3.0 multicharge/0.3.0-gfbf-2023a

Required By

This version of tblite is a direct dependent of: DFTB+/23.1-foss-2023a

Other Versions

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

Last modified on 18th November 2024