It is very important that you communicate clearly to the VASP group that we want emails on this address. The group representative of the user needs to contact the VASP team using and ask them to send a confirmation email to to confirm that the user have a valid license. We need to get a confirmation from a VASP representative to confirm that the user have access to the license. To acquire a licence, please consult the How can I purchase a VASP license?. The users research group must have a valid VASP licence. For a user to get access to the VASP executables installed on the Sigma2 systems they must perform the following steps: VASP is a commercial software package that requires a license for all who wants to use it.
6.1 (not yet installed, ETA will be notified, we are pending updates from the VASP group pertaining to agreements to install/maintain it on our clusters, in essence the agreements of a cluster maintenance license).
Online information from VASP developers targeted towards users
Please consult the documentation to get a more detailed overview of its feature set. The package can perform density-functional-theory (DFT) calculations, or many-body-perturbation-theory (MBPT) like GW etc. VASP is a software package for performing ab-initio quantum-mechanical calculation of a periodic arrangement of atoms using the projector-augmented wave method and a plane wave basis set. (VASP)= VASP (Vienna Ab initio Simulation Package)
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