Interaction of Small Molecules with Transition Metal Ions in Zeolites: The Effect of the Local Environment.

Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61388955%3A_____%2F02%3A54020132" target="_blank" >RIV/61388955:_____/02:54020132 - isvavai.cz</a>
Result on the web
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DOI - Digital Object Identifier
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Result language
angličtina
Original language name
Interaction of Small Molecules with Transition Metal Ions in Zeolites: The Effect of the Local Environment.
Original language description
The interaction of small molecules (CO, No, NO2, N2, H2O) with transition metal ions inside the zeolite matrix was studied with the combined quantum mechanics. Various sites of the transition metal ions located on the channel wall or on the channel intersection were investigated for ZSM-5 and FER matrices. The explanation of differences in catalytic activities of Cu/ZSM-5 and Cu/FER systems is also suggested based on the computational results.
Czech name
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Czech description
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Project
<a href="/en/project/LN00A032" target="_blank" >LN00A032: Structure and dynamics of complex molecular systems and biomolecules</a><br>
Continuities
P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)<br>Z - Vyzkumny zamer (s odkazem do CEZ)

Publication year
2002
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Article name in the collection
Impact of Zeolites and Other Porous Materials on the New Technologies at the Beginning of the New Millennium.
ISBN
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ISSN
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e-ISSN
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Number of pages
8
Pages from-to
101-108
Publisher name
Elsevier
Place of publication
Amsterdam
Event location
Taormina [IT]
Event date
Sep 1, 2002
Type of event by nationality
WRD - Celosvětová akce
UT code for WoS article
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