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Photoinduced Charge Transfer from Titania to Surface Doping Site

We evaluate a theoretical model in which Ru is substituting for Ti at the (100) surface of anatase TiO(2). Charge transfer from the photo-excited TiO(2) substrate to the catalytic site triggers the photo-catalytic event (such as water oxidation or reduction half-reaction). We perform ab-initio compu...

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Hlavní autoři: Inerbaev, Talgat, Hoefelmeyer, James D., Kilin, Dmitri S.
Médium: Artigo
Jazyk:Inglês
Vydáno: 2013
Témata:
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC3688295/
https://ncbi.nlm.nih.gov/pubmed/23795229
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp311076w
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