Physical Chemistry Chemical Physics

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Paper

On the structure and coordination of the oxygen-donating species in Ti↑MCM-41/TBHP oxidation catalysts: a density functional theory and EXAFS study

a
The Davy Faraday Research Laboratory, The Royal Institution of Great Britain, 21 Albemarle Street, London, UK
b
Department of Chemistry, University College London, 20 Gordon Street, London, UK
Phys. Chem. Chem. Phys., 2002,4, 1228-1240

DOI: 10.1039/B104735N
Received 31 May 2001, Accepted 25 Oct 2001
First published online 04 Mar 2002
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