作者
David O Scanlon, Charles W Dunnill, John Buckeridge, Stephen A Shevlin, Andrew J Logsdail, Scott M Woodley, C Richard A Catlow, Michael J Powell, Robert G Palgrave, Ivan P Parkin, Graeme W Watson, Thomas W Keal, Paul Sherwood, Aron Walsh, Alexey A Sokol
发表日期
2013/9
期刊
Nature materials
卷号
12
期号
9
页码范围
798-801
出版商
Nature Publishing Group UK
简介
The most widely used oxide for photocatalytic applications owing to its low cost and high activity is TiO2. The discovery of the photolysis of water on the surface of TiO2 in 1972 launched four decades of intensive research into the underlying chemical and physical processes involved,,,. Despite much collected evidence, a thoroughly convincing explanation of why mixed-phase samples of anatase and rutile outperform the individual polymorphs has remained elusive. One long-standing controversy is the energetic alignment of the band edges of the rutile and anatase polymorphs of TiO2 (ref. ). We demonstrate, through a combination of state-of-the-art materials simulation techniques and X-ray photoemission experiments, that a type-II, staggered, band alignment of ~ 0.4 eV exists between anatase and rutile with anatase possessing the higher electron affinity, or work function. Our results help to explain the robust …
引用总数
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学术搜索中的文章
DO Scanlon, CW Dunnill, J Buckeridge, SA Shevlin… - Nature materials, 2013