Theoretical Insights into the Mechanism of Selective Nitrate‐to‐Ammonia Electroreduction on Single‐Atom Catalysts

Selective nitrate‐to‐ammonia electrochemical conversion is an efficient pathway to solve the pollution of nitrate and an attractive strategy for low‐temperature ammonia synthesis. However, current studies for nitrate electroreduction (NO3RR) mainly focus on metal‐based catalysts, which remains chall...

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Veröffentlicht in:	Advanced functional materials 2021-03, Vol.31 (11), p.n/a
Hauptverfasser:	Niu, Huan, Zhang, Zhaofu, Wang, Xiting, Wan, Xuhao, Shao, Chen, Guo, Yuzheng
Format:	Artikel
Sprache:	eng
Schlagworte:	Ammonia ammonia synthesis Carbon nitride Density functional theory electrocatalysis Electrowinning first‐principles calculations Materials science nitrate reduction Nitrates Nitrogen dioxide Selectivity Single atom catalysts Titanium Transition metals Zirconium
Online-Zugang:	Volltext
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