Polycarbonyls on Cu+ ions in FER zeolites
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216275%3A25310%2F06%3A00004113" target="_blank" >RIV/00216275:25310/06:00004113 - isvavai.cz</a>
Result on the web
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DOI - Digital Object Identifier
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Alternative languages
Result language
angličtina
Original language name
Polycarbonyls on Cu+ ions in FER zeolites
Original language description
The preferred Cu+ sites and formation of mono-, di-, and tri-carbonyl complexes in the Cu-FER were investigated at the periodic density functional theory level and by means of FTIR spectroscopy. The site-specificity of adsorption enthalpies of CO on Cu-FER and of vibrational frequencies of polycarbonyl complexes were investigated for various Cu+ sites in Cu-FER
Czech name
Polykarbonyly na Cu+ iontech ve FER zeolitech
Czech description
Preference lokalizací a tvorba mono-, di- a tri-karbonylů na Cu+ iontech v Cu-FER zeolitech byla studována pomocí kvantové chemie a IČ spektroskopie. Pro různá Cu+ centra v Cu-FER zeolitech byla studována site-specificita adsorpčních enthalpií CO a vibračních frekvencí pro polykarbonylové komplexy vznikajicí v těchto systémech.
Classification
Type
J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)
CEP classification
CF - Physical chemistry and theoretical chemistry
OECD FORD branch
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Result continuities
Project
<a href="/en/project/GA203%2F06%2F0324" target="_blank" >GA203/06/0324: Bridging the gap between experimental and theoretical characterization of metal-ion exchanged zeolites</a><br>
Continuities
Z - Vyzkumny zamer (s odkazem do CEZ)
Others
Publication year
2006
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
Physical Chemistry Chemical Physics
ISSN
1463-9076
e-ISSN
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Volume of the periodical
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Issue of the periodical within the volume
8
Country of publishing house
GB - UNITED KINGDOM
Number of pages
8
Pages from-to
5535-5542
UT code for WoS article
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EID of the result in the Scopus database
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