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Single-, Double-, and Triple-Atom Catalysts on PC6 6 for Nitrate Reduction to Ammonia: A Computational Screening

Jinrui Huang, Shixiang Hu,Mengran Liu,Zhichao Ma,Tianfang Yang,Yingjie Yang,Yang Liu,Shuyan Gao

ELECTROCHIMICA ACTA（2024）

Cited 0|Views7
Key words
Multiple-atom catalysts,Potential-determining step,*H equilibrium,Synergistic effect,Ammonia synthesis
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