电化学
析氧
催化作用
化学
氧化还原
密度泛函理论
氮气
无机化学
化学工程
组合化学
计算化学
物理化学
有机化学
电极
工程类
作者
Hao Wan,Alexander Bagger,Jan Rossmeisl
标识
DOI:10.1021/acs.jpclett.2c02459
摘要
and *O as the rate-determining step (RDS). Following the RDS, a microkinetic model is utilized to study the rate of NOR on metal oxides. Our results demonstrate that a lower activation energy is obtained when a catalyst binds *O weakly. We show that the reaction is extremely challenging but also that design strategies have been suggested to promote electrochemical NOR.
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