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Boronat Zaragoza, M.; Corma Canós, A.; Illas, F.; Radilla, J.; Ródenas, T.; Sabater Picot, MJ. (2011). Mechanism of selective alcohol oxidation to aldehydes on gold catalysts: influence of surface roughness on reactivity. Journal of Catalysis. 278(1):50-58. https://doi.org/10.1016/j.cat.2010.11.013
Por favor, use este identificador para citar o enlazar este ítem: http://hdl.handle.net/10251/140988
Título: | Mechanism of selective alcohol oxidation to aldehydes on gold catalysts: influence of surface roughness on reactivity | |
Autor: | Illas, Francesc Radilla, Juan | |
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[EN] The complete reaction pathway for the selective alcohol oxidation to aldehyde has been obtained from periodic density functional theory (DFT) calculations on a series of catalyst models having Au atoms with different ...[+]
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Derechos de uso: | Cerrado | |
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Versión del editor: | https://doi.org/10.1016/j.jcat.2010.11.013 | |
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We thank Consolider-Ingenio 2010 (project MULTICAT), Spanish MICINN (Projects FIS2008-02238 and MAT2006-14274- C02-01), Generalitat Valenciana (Project PROMETEO/2008/130), Generalitat de Catalunya (grants 2009SGR1041 and ...[+]
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