tblite 0.2.1-gfbf-2022b
The tblite project aims to provide an efficent and uniform interface to the (extended) tight-binding Hamiltonians.Accessing tblite 0.2.1-gfbf-2022b
To load the module for tblite 0.2.1-gfbf-2022b please use this command on the BEAR systems (BlueBEAR and BEAR Cloud VMs):
📋
module load bear-apps/2022b
module load tblite/0.2.1-gfbf-2022b
BEAR Apps Version
Architectures
EL8-cascadelake — 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: dftd4/3.4.0-gfbf-2022b gfbf/2022b mctc-lib/0.3.1-GCC-12.2.0 mstore/0.2.0-GCC-12.2.0 multicharge/0.2.0-gfbf-2022b
Required By
This version of tblite is a direct dependent of: QCxMS/5.2.1-gfbf-2022b
Last modified on 17th July 2024