Mo掺杂<i>α</i>-MnO<sub>2</sub>电催化析氧反应的理论研究

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Mo掺杂α-MnO₂电催化析氧反应的理论研究

王鹏(

), 靳遵龙(

), 陈宁光, 刘勇豪

Theoretical Investigation of Mo Doped α-MnO₂ Electrocatalytic Oxygen Evolution Reaction

WANG Peng(

), JIN Zunlong(

), CHEN Ningguang, LIU Yonghao

图1. (a) α-MnO₂(001)和(b) Mo掺杂α-MnO₂(001)优化结构的俯视图

Fig. 1. Top view of optimized structures for (a) α-MnO₂(001) and (b)Mo doped α-MnO₂(001)