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Posted on November 30, 2017

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.

Note: The following additional versions of this software are located in the supplemental software stack at “/gpfs/group/RISE/sw7”. Access to some items in this stack is limited due to licensing restrictions; contact the i-ASK helpdesk for access.

  • vasp/vasp-5.4.1a
  • vasp/vasp-5.4.1v
  • vasp/vasp-5.4.4a-vtst
  • vasp/vasp-5.4.4v
  • vasp/vasp-5.4.4vtst


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