MuST version 1.5
Available on bridges2-gpu-ai.psc.access-ci.org
Description
MuST is software package designed for performing ab initio electornic structure calculations for metals, alloys, and nanostructures. It is an all-electron DFT code based on multiple scattering theory, also known as KKR method, and Green function techniques.
Access from a Shell
Use the following command to load this software:
module load MuST/ 1.5
This command should be run on bridges2-gpu-ai.psc.access-ci.org
Scientific Domain
Materials Sciences
Keywords
DFT
ab initio
multiple scattering theory
Green function
KKR
KKR-CPA
LSMS
Software Attributes
- Software Type:
- Module
- Name:
- MuST
- Version:
- 1.5
- Hosted On:
- bridges2-gpu-ai.psc.access-ci.org
- Provided By:
- psc.access-ci.org
- Last Updated:
- Quality Level:
- Production
- Audience:
- access-ci.org