vasp¶
Description¶
The Vienna Ab initio Simulation Package (VASP) is a computer program for atomic scale materials modelling, e.g. electronic structure calculations and quantum-mechanical molecular dynamics, from first principles.
Homepage¶
Available Versions on RCAC Clusters¶
| Cluster | Versions |
|---|---|
| ANVIL | 5.4.4.pl2, 5.4.4.pl2-vtst, 6.3.0, 6.3.0-beef, 6.3.0-gpu, 6.3.0-sol, 6.3.0-vtst, 6.3.0-wannier90 |
| BELL | 5.4.4.pl2, 6.4.1 |
| GAUTSCHI | 6.4.3-beef, 6.4.3-vtst, 6.4.3 |
| GILBRETH | 6.4.1 |
| NEGISHI | 5.4.4.pl2, 6.4.1_vtst, 6.4.1 |
Module¶
You can load the module by:
Note for using vasp
Run module spider vasp beforehand to check if this version requires any prerequisite modules.