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Updated: May 19, 2026

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

Published on: April 12, 2019

Quantum chemical characterization of the mechanism of a supported cobalt-based water oxidation catalyst

Mehmed Z Ertem1, Christopher J Cramer

  • 1Department of Chemistry and Supercomputer Institute, University of Minnesota, 207 Pleasant St. SE, Minneapolis, MN 55455, USA.

Dalton Transactions (Cambridge, England : 2003)
|August 30, 2012
PubMed

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