Orbital Orientation-based Theoretical Design of Single-Atom Catalysts for the Hydrogen Evolution Reaction

Hydrogen evolution reaction (HER) is regarded as one of the most effective routes to produce H2, but it usually suffers from the lack of the novel design concept of high-efficiency catalysts, especially in neutral condition. Herein, we report an orbital orientation-based theoretical principle for de...

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Veröffentlicht in:	Journal of physical chemistry. C 2022-10, Vol.126 (39), p.16656-16662
Hauptverfasser:	Zhang, Fengchu, Yi, Ding, Wang, Xi, Li, Sha
Format:	Artikel
Sprache:	eng
Schlagworte:	C: Chemical and Catalytic Reactivity at Interfaces
Online-Zugang:	Volltext
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