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Understanding the interface between oxides and metals

Catlow, C. Richard A., French, Simon, Sokol, A.A., Alfredsson, Maria, Bromley, S.T. (2003) Understanding the interface between oxides and metals. Faraday Discussions, 124 . pp. 185-203. ISSN 1364-5498. (doi:10.1039/b211661h) (The full text of this publication is not currently available from this repository. You may be able to access a copy if URLs are provided) (KAR id:4771)

The full text of this publication is not currently available from this repository. You may be able to access a copy if URLs are provided. (Contact us about this Publication)
Official URL
https://doi.org/10.1039/b211661h

Abstract

Computational methods based on DFT are applied to modelling structure and bonding in oxide supported metals. We examined three systems of contemporary interest: Cu/ZnO, Pd,Pt/ZrO2 and bimetallic transition metal clusters on silica supports.

Item Type: Article
DOI/Identification number: 10.1039/b211661h
Additional information: ISI Document Delivery No.: 710MW Times Cited: 11 Cited Reference Count: 74
Uncontrolled keywords: METHANOL SYNTHESIS CATALYSTS ELECTRONIC-STRUCTURE CALCULATIONS TERMINATED ZNO(0001) SURFACE DENSITY-FUNCTIONAL THEORY GAUSSIAN-BASIS SETS CUBIC ZIRCONIA ABSORPTION-SPECTROSCOPY POPULATION ANALYSIS SPIN-RESONANCE ACTIVE-SITES
Subjects: Q Science
Divisions: Faculties > Sciences > School of Physical Sciences > Functional Materials Group
Depositing User: Maria Alfredsson
Date Deposited: 05 Sep 2008 11:22 UTC
Last Modified: 06 May 2020 03:01 UTC
Resource URI: https://kar.kent.ac.uk/id/eprint/4771 (The current URI for this page, for reference purposes)
Alfredsson, Maria: https://orcid.org/0000-0002-2843-1641
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