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Updated: Jul 3, 2026

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
10:52

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics

Published on: April 12, 2019

Zn modificación de la reactividad de Pd(111) hacia el metanol y el formaldehído

Eseoghene Jeroro1, John M Vohs

  • 1Department of Chemical and Bimolecular Engineering, University of Pennsylvania, Philadelphia, Pennsylvania 19104-6363, USA.

Journal of the American Chemical Society
|July 11, 2008
PubMed
Resumen

El zinc en los catalizadores a base de paladio reduce significativamente la deshidrogenación del metanol y altera la unión intermedia. Esta investigación aclara el papel del zinc en los catalizadores de palladio/óxido de zinc para la reformación por vapor del metanol.

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