Protons in oxides

C. R. A. Catlow Davy Faraday Research Laboratory, The Royal Institution of Great Britain, 21 Albemarle Street, London, W1X 4BS, U.K.

P. S. Baram Department of Chemistry, University of Bath, Claverton Down, Bath, U. K.

S. C. Parker Department of Chemistry, University of Bath, Claverton Down, Bath, U. K.

J. Purton Department of Chemistry, University of Bath, Claverton Down, Bath, U. K.

K. V. Wright Materials Science Centre, University of Manchester and UMIST, Grosvenor Street, Manchester, M1 7HS, UK

Abstract

We discuss the nature of the defects involved in the incorporation of hydrogen in oxides and silicates. We describe how computational techniques may be used to investige the structures and energies of hydrogen containing defects in these materials.

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Protons in oxides

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