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Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
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Published on: April 12, 2019

Universal transition state scaling relations for (de)hydrogenation over transition metals

S Wang1, V Petzold, V Tripkovic

  • 1Center for Atomic-scale Materials Design, Department of Physics, Building 307, Technical University of Denmark, DK-2800 Kgs. Lyngby, Denmark.

Physical Chemistry Chemical Physics : PCCP
|October 15, 2011
PubMed

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