Mingjie Pu

Wrinkling Facilitated Hydrogen Evolution Reaction on Non-Noble Transition-Metal Single Atoms Anchored at Vacancy-Defected MoS2 Monolayer

Abstract Activating and enhancing the electrocatalytic performance of the monolayer MoS2 basal plane is crucial for reducing the cost of the hydrogen production. By screening fourth-period transition metal single atoms and combining extensive first-principles calculations, we fin...