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Statements

Subject Item
n2:RIV%2F61388955%3A_____%2F01%3A54010081%21RIV%2F2003%2FAV0%2FA54003%2FN
rdf:type
n16:Vysledek skos:Concept
dcterms:description
Reliability of various models commonly used for the description of interaction of transition metal ions with zeolite matrices was investigated and discused. Currently the most reliable combined quantum mechanics/molecular mechanics model was used for the study of copper ion interaction with high-silica zeolite matrices (ZSM-5,FER). The interaction of copper sites inside the zeolite matrices with NO molecule was also investigated. Reliability of various models commonly used for the description of interaction of transition metal ions with zeolite matrices was investigated and discused. Currently the most reliable combined quantum mechanics/molecular mechanics model was used for the study of copper ion interaction with high-silica zeolite matrices (ZSM-5,FER). The interaction of copper sites inside the zeolite matrices with NO molecule was also investigated.
dcterms:title
Ab initio Simulation of Cu-Species in Zeolites: Siting, Coordination, UV-VIS Spectra and Reactivity. Ab initio Simulation of Cu-Species in Zeolites: Siting, Coordination, UV-VIS Spectra and Reactivity.
skos:prefLabel
Ab initio Simulation of Cu-Species in Zeolites: Siting, Coordination, UV-VIS Spectra and Reactivity. Ab initio Simulation of Cu-Species in Zeolites: Siting, Coordination, UV-VIS Spectra and Reactivity.
skos:notation
RIV/61388955:_____/01:54010081!RIV/2003/AV0/A54003/N
n3:strany
221;234
n3:aktivita
n17:P n17:Z
n3:aktivity
P(GA203/97/P011), P(LN00A032), Z(AV0Z4040901)
n3:dodaniDat
n9:2003
n3:domaciTvurceVysledku
n18:1747681 n18:9831339
n3:druhVysledku
n13:D
n3:duvernostUdaju
n19:S
n3:entitaPredkladatele
n20:predkladatel
n3:idSjednocenehoVysledku
672397
n3:idVysledku
RIV/61388955:_____/01:54010081
n3:jazykVysledku
n14:eng
n3:klicovaSlova
ZSM-5; - copper ions coordination; - UV-VIS
n3:klicoveSlovo
n6:ZSM-5 n6:-%20copper%20ions%20coordination n6:-%20UV-VIS
n3:kontrolniKodProRIV
[A70D0B52EDFD]
n3:mistoKonaniAkce
Praha-Průhonice [CZ]
n3:mistoVydani
Dordrecht
n3:nazevZdroje
Proceedings of the NATO Advanced Research Workshop on Catalysis by Unique Metal Ion Structures in Solid Matrices.
n3:obor
n12:CF
n3:pocetDomacichTvurcuVysledku
2
n3:pocetTvurcuVysledku
3
n3:pocetUcastnikuAkce
0
n3:pocetZahranicnichUcastnikuAkce
0
n3:projekt
n4:LN00A032 n4:GA203%2F97%2FP011
n3:rokUplatneniVysledku
n9:2001
n3:tvurceVysledku
Sauer, J. Nachtigallová, Dana Nachtigall, Petr
n3:typAkce
n15:WRD
n3:zahajeniAkce
2000-07-04+02:00
n3:zamer
n10:AV0Z4040901
s:numberOfPages
14
n8:hasPublisher
Kluwer Academic