Termination effects of single-atom decorated v-Mo2CTx MXene for the electrochemical nitrogen reduction reaction

Xingwu Zhai, Haoxi Dong,Yafei Li,Xiaodong Yang,Lei Li,Jueming Yang,Yanwen Zhang,Jinli Zhang,Hongxia Yan,Guixian Ge

Journal of Colloid and Interface Science（2022）

引用 25|浏览25

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摘要

Various termination surfaces affect the valence states of Ir atoms, resulting in different NRR activities. The synergistic effects of decorated Ir atom and the surface O-terminations for Ir@v-Mo2CO2 leads to promoted NRR performance during the first hydrogenation.

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关键词

Density functional theory,Electrochemical nitrogen reduction,Single-atom catalysts,Termination effects,MXenes

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