"Hlavn\u00EDm c\u00EDlem projektu jsou kombinovan\u00E9 v\u00FDpo\u010Dty elektronick\u00E9 struktury a dynamick\u00E9 v\u00FDpo\u010Dty t\u00FDkaj\u00EDc\u00ED se adsorpce vod\u00EDku a halogen\u016F na grafenu za \u00FA\u010Delem komplexn\u00EDho porozum\u011Bn\u00ED adsorp\u010Dn\u00EDho procesu. D\u00EDl\u010D\u00ED c\u00EDle zahrnuj\u00ED: v\u00FDpo\u010Dty nadploch potenci\u00E1ln\u00EDch energi\u00ED pro syst\u00E9my atom-grafen, v\u00FDpo\u010Dty vazeb (coupling) atom-fonon, zahrnut\u00ED excitac\u00ED elektron-d\u00EDra a proveden\u00ED dynamick\u00FDch v\u00FDpo\u010Dt\u016F adsorpce n\u011Bkolika metodami."@cs . . . . "Main goals of the present project involve combined electronic structure and dynamical calculations, giving a clear view on complex adsorption processes. Partial goals are: calculations of an atom-substrate electronic potential energy surface, calculations of atom-phonon couplings, inclusion of electron-hole pair excitations, and dynamical calculation using several dynamical methods like reduced density matrix or close coupling wavepacket propagations."@en . . "1"^^ . . "1"^^ . . "Adsorption properties of graphene"@en . "2012-01-01+01:00"^^ . "0"^^ . "148"^^ . "2013-12-31+01:00"^^ . "1"^^ . "Adsorp\u010Dn\u00ED vlastnosti grafenu"@cs . . . "graphene; adsorption; sticking; hydrogen; halogens"@en . "148"^^ . . "0"^^ . . .