7.2. Running Vasp 6 on OLCF

To access vasp, you must first obtain a license from the authors and process it through help@olcf.ornl.gov.

The vasp codes are located at /sw/summit/vasp/6.1.0/bin, and contain:

• vasp_std - Standard vasp.
• vasp_ncl - Standard vasp compiled a different way.
• vasp_gam - Specialized code for running at the gamma-point (i.e. no k-point replicas)