Nature of Copper Active Sites in CuZSM-5: Theory and Experiment

Nature of Copper Active Sites in CuZSM-5: Theory and Experiment

Abstract: We report here a concise resume reporting the way of constructing the model of an active site composed of transition metal cation exchanged in zeolites. The main goal was to devise the model of CuZSM-5 capable of describing geometrical and electronic properties of metal sites and adsorptio...

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Bibliographic Details
Main Authors: Pawel Kozyra, Barbara Gil, Jerzy Datka, Ewa Broclawik
Format: Article
Language:English
Published: MDPI AG 2002-04-01
Series:International Journal of Molecular Sciences
Subjects:
CuZSM-5
deNOx
active sites
molecular modeling
density functional theory
Online Access:http://www.mdpi.com/1422-0067/3/4/435/

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http://www.mdpi.com/1422-0067/3/4/435/

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