Energy of Step Defects on the TiO 2 Rutile (110) Surface: An ab initio DFT Methodology

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Bibliographic Details
Published in:Journal of physical chemistry. C 2013-11, Vol.117 (45), p.23766-23780
Main Authors: Hardcastle, Trevor P., Seabourne, Che R., Brydson, Rik M. D., Livi, Ken J. T., Scott, Andrew J.
Format: Article
Language:English
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ISSN:1932-7447
1932-7455
DOI:10.1021/jp4078135