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• W2626522269 endingPage "15332" @default.
• W2626522269 startingPage "15326" @default.
• W2626522269 abstract "CO2 hydrogenation to methanol, a renewable fuel, under benign conditions and without the use of sacrificial agents is a rarity and certainly a much sought after goal of present-day research. Herein, we report using well calibrated computational tools the viability of hydrogenating CO2 to CH3OH and pyridine to 1,2-dihydropyridine, a renewable organohydride which can also reduce CO2 to CH3OH sustainably, using hydrogens chemisorbed on Au(111) surface of Au20 by photo-excitation. Our studies predict that these hydrogenations can occur at appreciable rates at room temperature. Thus, we reveal the untapped potential of the chemisorbed hydrogens on Au(111) surface, achieved by hot-electron generation through photo-excitation, in facilitating endoergic hydrogenations akin to those enabled by NADPH." @default.
• W2626522269 created "2017-06-23" @default.
• W2626522269 creator A5037182436 @default.
• W2626522269 creator A5062973771 @default.
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• W2626522269 date "2017-07-05" @default.
• W2626522269 modified "2023-10-01" @default.
• W2626522269 title "Photochemical Hydrogenation of CO₂ to CH₃OH and Pyridine to 1,2-Dihydropyridine Using Plasmon-Facilitated Chemisorbed Hydrogen on Au Surface: Theoretical Perspective" @default.
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• W2626522269 doi "https://doi.org/10.1021/acs.jpcc.7b03080" @default.
• W2626522269 hasPublicationYear "2017" @default.
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