The students will use quantum chemistry methods to model the structure, reactivity, catalytic activity and properties of zeolites.
The work will include employing different computational approaches - mainly QM-Pot and VASP - and will be done in a close collaboration with experimentalists of the J. Heyrovsky Institute.
Stepan Sklenak, PhD.
Senior Scientist and Purkyne Fellow
Department of Theoretical Chemistry
J. Heyrovsky Institute of Physical Chemistry of the Academy of Sciences of the Czech Republic, v.v.i.
CZ-18223 Prague 8
E-mail: web page: http://www.jh-inst.cas.cz/~sklenak