Single atom-doped arsenene as electrocatalyst for reducing nitrogen to ammonia: a DFT study

Due to the wide application of NH 3 in the energy and chemical industry, the rational design of a highly efficient and low-cost electrocatalyst for nitrogen fixation at moderate conditions is highly desirable to meet the increasing demand for sustainable energy production in the modern society. Here...

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Veröffentlicht in:	Physical chemistry chemical physics : PCCP 2020-11, Vol.22 (45), p.26223-2623
Hauptverfasser:	Xu, Ziwei, Song, Ruofei, Wang, Mingyuan, Zhang, Xiangzhao, Liu, Guiwu, Qiao, Guanjun
Format:	Artikel
Sprache:	eng
Schlagworte:	Adsorption Ammonia Catalysts Chemical industry Chemical reduction Chromium Cobalt Copper Density functional theory Electrocatalysts Gold Iron Nanomaterials Nitrogen Nitrogenation Palladium Platinum Ruthenium Silver Transition metals
Online-Zugang:	Volltext
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