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Kim, Yu Kwon; Kay, Bruce D.; White, J. M.; Dohnalek, Zdenek
Pacific Northwest National Lab., Richland, WA (United States), Environmental Molecular Sciences Laboratory (US). Funding organisation: US Department of Energy (United States)2007
Pacific Northwest National Lab., Richland, WA (United States), Environmental Molecular Sciences Laboratory (US). Funding organisation: US Department of Energy (United States)2007
AbstractAbstract
[en] Reactivity of adsorbates with titania is typically influenced by the presence of surface oxygen vacancy defects. For alcohols, it is well-established that their dissociation on bridge-bonded oxygen vacancies (BBOV's) of a prototypical TiO2(110) surface proceeds via heterolytic cleavage of the RO-H bond. The resulting intermediates are alkoxide (RO) that fills the vacancy and a proton that binds to a neighboring oxygen anion. Except for methoxide, these alkoxides dehydrate at elevated temperatures (well above 300 K) via β-hydride elimination to form alkenes.In some cases, the dehydration is accompanied by a minority dehydrogenation channel yielding aldehydes
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Source
PNNL-SA--54909; 17490;KC0302010; AC06-76RL01830
Record Type
Journal Article
Journal
Catalysis Letters; ISSN 1011-372X;
; v. 119(1-2); p. 1-4

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