- Unit: Faculty of Physics
- Keywords: Supercomputer, high performance computing, HPC, quantum chemistry, molecular mechanics, Gamess, NwChem, Dalton, Gausian09, Amber12, Crystal, VASP
Quantum chemistry and molecular mechanics calculations, using Gamess, NwChem, Dalton, Gausian09, Amber12, Crystal, VASP software. Consultations on using the applied programmes on a supercomputer.
Application. Calculations and research using the before-mentioned software.