Related Experiment Video

Updated: Jul 18, 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

Unravelling the origin of the high-catalytic activity of supported Au: a density-functional theory-based

Norge Cruz Hernandez1, Javier Fdez Sanz, José A Rodriguez

  • 1Departamento de Química Física, Facultad de Química, Universidad de Sevilla, E-41012 Sevilla, Spain.

Journal of the American Chemical Society
|December 7, 2006
PubMed

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