Online Workshop: VASP/EMTO Best Practices Workshop
16-18 April 2024
NAISS and ENCCS organise the VASP/EMTO Best Practices Workshop. During the workshop we will showcase how to run the VASP (Vienna Ab-initio Simulation Package) and the EMTO (Exact Muffin-Tin Orbitals) packages efficiently on supercomputers. This workshop includes:
- basic theory, DFT and PAW-method;
- general introduction to VASP and EMTO, essential files and parameters, workflow;
- running VASP at HPC centers, CPUs and GPUs (examples from NAISS);
- performance analysis;
- common issues;
- post-processing tools; and
- running VASP/EMTO calculations step-by-step on the Tetralith and Leonardo Booster clusters.
Time: 16-18 April 2024, 10:00-15:00
Detailed information and access to registration are handled on the ENCCS webpage:
https://enccs.se/events/vasp-emto-best-practices-workshop/