About: Computational and fourier transform infrared spectroscopic studies on carbon monoxide adsorption on the zeolites Na-ZSM-5 and K-ZSM-5: Evidence of dual-cation sites

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About: Computational and fourier transform infrared spectroscopic studies on carbon monoxide adsorption on the zeolites Na-ZSM-5 and K-ZSM-5: Evidence of dual-cation sites Goto Sponge NotDistinct Permalink

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rdf:type	skos:Concept http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description	Kombinace experimentální VTIR spektroskopie s výpočty provedenými na úrovni peroidického DFT modelu byla použita ke studiu adsorpce CO na zeolitech Na-ZSM-5 a K-ZSM-5. Na základě velmi dobré shody experimentálních a vypočtených vibračních frekvencí a adsorpčních enthalpií bylo potvrzeno, že molekly CO mohou vytvářet karbonyly mezi dvěma kationty v tzv. duálních kationtových pozicích. (cs) A combination of variable temperature FTIR spectroscopy with calculations performed at the periodic DFT level was used in the investigation of CO adsorption on zeolites Na-ZSM-5 and K-ZSM-5. On the basis of a very good agreement between experimental and calculated frequencies and adsorption enthalpies it is concluded that CO can form a linearly bridged adsorption complexes on the dual cation sites. A combination of variable temperature FTIR spectroscopy with calculations performed at the periodic DFT level was used in the investigation of CO adsorption on zeolites Na-ZSM-5 and K-ZSM-5. On the basis of a very good agreement between experimental and calculated frequencies and adsorption enthalpies it is concluded that CO can form a linearly bridged adsorption complexes on the dual cation sites. (en)
Title	Computational and fourier transform infrared spectroscopic studies on carbon monoxide adsorption on the zeolites Na-ZSM-5 and K-ZSM-5: Evidence of dual-cation sites Teoretická a FTIR studie adsorpce CO v zeolitech Na-ZSM-5 a K-ZSM-5: evidence duálních kationtových pozic (cs) Computational and fourier transform infrared spectroscopic studies on carbon monoxide adsorption on the zeolites Na-ZSM-5 and K-ZSM-5: Evidence of dual-cation sites (en)
skos:prefLabel	Computational and fourier transform infrared spectroscopic studies on carbon monoxide adsorption on the zeolites Na-ZSM-5 and K-ZSM-5: Evidence of dual-cation sites Teoretická a FTIR studie adsorpce CO v zeolitech Na-ZSM-5 a K-ZSM-5: evidence duálních kationtových pozic (cs) Computational and fourier transform infrared spectroscopic studies on carbon monoxide adsorption on the zeolites Na-ZSM-5 and K-ZSM-5: Evidence of dual-cation sites (en)
skos:notation	RIV/61388963:_____/08:00306339!RIV08-AV0-61388963
http://linked.open.../vavai/riv/strany	4658;4666
http://linked.open...avai/riv/aktivita	P Z
http://linked.open...avai/riv/aktivity	P(GA203/06/0324), P(LC512), Z(AV0Z40550506)
http://linked.open...iv/cisloPeriodika	12
http://linked.open...vai/riv/dodaniDat	2008
http://linked.open...aciTvurceVysledku	Nachtigall, Petr Pulido, Maria Angeles
http://linked.open.../riv/druhVysledku	J - Článek v odborném periodiku
http://linked.open...iv/duvernostUdaju	S - Úplné a pravdivé údaje nepodléhající ochraně podle zvláštních právních předpisů
http://linked.open...titaPredkladatele	Ústav organické chemie a biochemie AV ČR, v. v. i.
http://linked.open...dnocenehoVysledku	360860
http://linked.open...ai/riv/idVysledku	RIV/61388963:_____/08:00306339
http://linked.open...riv/jazykVysledku	eng - angličtina
http://linked.open.../riv/klicovaSlova	zeolit; adsorpce; FTIR (en)
http://linked.open.../riv/klicoveSlovo	FTIR adsorpce zeolit
http://linked.open...odStatuVydavatele	US - Spojené státy americké
http://linked.open...ontrolniKodProRIV	[2C3D99CACC51]
http://linked.open...i/riv/nazevZdroje	Journal of Physical Chemistry C
http://linked.open...in/vavai/riv/obor	CF
http://linked.open...ichTvurcuVysledku	2 (xsd:int)
http://linked.open...cetTvurcuVysledku	7 (xsd:int)
http://linked.open...vavai/riv/projekt	Center for biomolecules and complex molecular systems Bridging the gap between experimental and theoretical characterization of metal-ion exchanged zeolites
http://linked.open...UplatneniVysledku	2008
http://linked.open...v/svazekPeriodika	112
http://linked.open...iv/tvurceVysledku	Areán, C. O. Bulánek, R. Delgado, M. R. Frolich, K. Nachtigall, Petr Bibiloni, G. F. Pulido, Maria Angeles
http://linked.open...n/vavai/riv/zamer	Regulace biologických procesů: Chemické modulátory vybraných systémů významných pro medicínu a zemědělství
issn	1932-7447
number of pages	9 (xsd:int)

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