QUANTUM-CHEMICAL STUDY OF ACTIVE SITES OF GOLD NANOCLUSTERS

QUANTUM-CHEMICAL STUDY OF ACTIVE SITES OF GOLD NANOCLUSTERS

The results of systematic quantum-chemical study of different hydrocarbons adsorption and activation on gold clusters, and the investigation of the nature of active sites including the influence of cluster’s structure and charge on its chemical properties are presented. It is shown that Auδ+ sites a...

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Bibliographic Details
Main Authors: D.A. Pichugina, D.F. Mukhamedzyanova, S.N. Lanin
Format: Article
Language:Russian
Published: Tver State University 2011-12-01
Series:Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов
Subjects:
Gold clusters
density functional theory
catalysis
adsorption
hydrocarbons
allylbenzene
isomerization
Online Access:http://physchemaspects.ru/archives/2011/%D0%A4%D0%A5-2011%20%D0%9F%D0%B8%D1%87%D1%83%D0%B3%D0%B8%D0%BD%D0%B0%20%D0%94%D0%90.pdf

Internet

http://physchemaspects.ru/archives/2011/%D0%A4%D0%A5-2011%20%D0%9F%D0%B8%D1%87%D1%83%D0%B3%D0%B8%D0%BD%D0%B0%20%D0%94%D0%90.pdf

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