Reaction paths for hydrodeoxygenation of furfuryl alcohol at TiO2/Pd interfaces

Shyam Deo,Will Medlin,Eranda Nikolla,Michael J. Janik

Journal of Catalysis（2019）

引用 20|浏览12

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摘要

•DFT is used to examine hydrodeoxygenation of furfuryl alcohol at TiO2/Pd interfaces.•Reduced TiO2/Pd interfaces activate the CO bond of furfuryl alcohol.•TiO2/Pd interfaces provide bifunctionality for hydrodeoxygenation.•Interface sites do not accelerate non-selective decarbonylation (CC breaking).

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关键词

DFT,Furfural,Hydrodeoxygenation,Biomass,Metal-metal oxide interfaces

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