"870;875" . . "Chemick\u00E9 Listy" . "P(LN00A032), Z(AV0Z4040901)" . "Several models (cluster, periodic and hybrid) and methods of the description of properties of transition metal ions in zeolites are reviewed and their reliability is discussed. It is concluded that the combined quantum mechanics/interatomic potential function technique is a suitable approach to the description of transition metal/zeolite systems. The computational results offer interpretation of some experimental data at the atomic scale level."@en . "RIV/61388955:_____/02:54020244!RIV/2003/AV0/A54003/N" . "2"^^ . . "Suitability of Computational Chemistry Methods for the Description of Properties of Transition Metals in Zeolites."@en . . "zeolites; ZSM-5; MFI"@en . . . . . "Suitability of Computational Chemistry Methods for the Description of Properties of Transition Metals in Zeolites."@en . "Nachtigall, Petr" . "Davidov\u00E1, Mark\u00E9ta" . "Mo\u017Enosti modern\u00ED po\u010D\u00EDta\u010Dov\u00E9 chemie pro popis vlastnost\u00ED p\u0159echodn\u00FDch kov\u016F v zeolitech."@cs . "Mo\u017Enosti modern\u00ED po\u010D\u00EDta\u010Dov\u00E9 chemie pro popis vlastnost\u00ED p\u0159echodn\u00FDch kov\u016F v zeolitech." . . "0009-2770" . . . "96" . "C\u00EDlem p\u0159\u00EDsp\u011Bvku je uk\u00E1zat mo\u017Enosti modern\u00ED po\u010D\u00EDta\u010Dov\u00E9 chemie p\u0159i teoretick\u00E9m modelov\u00E1n\u00ED struktury a vlastnost\u00ED p\u0159echodn\u00FDch kov\u016F v zeolitech. Hlavn\u00ED pozornost je v\u011Bnov\u00E1na metod\u00E1m umo\u017E\u0148uj\u00EDc\u00EDm popis syst\u00E9mu na relativn\u011B spolehliv\u00E9 kvantov\u011B-chemick\u00E9 \u00FArovni." . . "Mo\u017Enosti modern\u00ED po\u010D\u00EDta\u010Dov\u00E9 chemie pro popis vlastnost\u00ED p\u0159echodn\u00FDch kov\u016F v zeolitech." . "CZ - \u010Cesk\u00E1 republika" . . "[F1B14D53654D]" . . . "N/A" . . . . "Mo\u017Enosti modern\u00ED po\u010D\u00EDta\u010Dov\u00E9 chemie pro popis vlastnost\u00ED p\u0159echodn\u00FDch kov\u016F v zeolitech."@cs . . "654417" . "RIV/61388955:_____/02:54020244" . "0"^^ . "0"^^ . "6"^^ . "2"^^ .