First-Principles-Based Kinetic Monte Carlo Model of Hydrogen Evolution Reaction under Realistic Conditions: Solvent, Hydrogen Coverage and Electric Field Effects

Yuhong Luo; Yani Guan; Guihua Liu; Yanji Wang; Jingde Li; Luis Ricardez-Sandoval

doi:10.1021/acscatal.3c04588

journal article Feb 07, 2024

First-Principles-Based Kinetic Monte Carlo Model of Hydrogen Evolution Reaction under Realistic Conditions: Solvent, Hydrogen Coverage and Electric Field Effects

Yuhong Luo

Luis Ricardez-Sandoval

ACS Catalysis Vol. 14 No. 4 pp. 2696-2708 · American Chemical Society (ACS)

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Details

Published: Feb 07, 2024
Vol/Issue: 14(4)
Pages: 2696-2708
License: View

Authors

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Yuhong Luo