Computational cluster - Catalysis
Instrument: Computer cluster of "Heterogeneous catalysis: Theory and Experiment" group
Location: Institute server room with remote access
Hardware: The computational cluster consists of over 150 cores. RAM varies between 2 and 8 GB per core, depending on the server. Total disk space is 14TB.
Quantum-chemical programs: Gaussian, Turbomole, VASP, wien2k, StoBe
Other: COMSOL Multiphysics, Matlab, gromacs, Intel MKL numerical libraries
Contact: dr Robert Gryboś tel. 12 6395 120
Access to the compuational cluster is possible after obtaining a cluster account and attending a short training in using the queueing system.