VASP-OMC

Software description

Modified VASP for occupation matrix control. VASP - Vienna ab initio simulation package, “a computer program for atomic scale materials modelling, e.g. electronic structure calculations and quantum mechanical molecular dynamics, from first principles.”

License

Note: VASP is a licensed software. Please check further information on the licensing page: www.nsc.liu.se/software/software-licensing/vasp/

Homepage: github.com/WatsonGroupTCD

NSC documentation

Available Modules


5.4.4.16052018-nsc1-intel-2018a-eb

Load with:

[user@system ~]$ module load VASP-OMC/5.4.4.16052018-nsc1-intel-2018a-eb