Screening antimonene-based single-atom catalysts for nitric oxide electroreduction to ammonia by density functional theory computations

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Authors: Qiuli Song, Zhenghaoyang Zhu, Yuejie Liu, Peng Wu, Jingxiang Zhao
Cited by: 1
References: 57

Abstract

Au/Sb exhibits the best NORR performance with the d-band center and charge transfer as key descriptors.

Fields of Study & Subjects

Ammonia Synthesis and Nitrogen Reduction Electrocatalysts for Energy Conversion CO2 Reduction Techniques and Catalysts

Publication details

Journal / source
New Journal of Chemistry
Publisher
Royal Society of Chemistry (RSC)
Volume
50
Issue
16
Pages
6827–6834
Publication date
1 January 2026
Language
EN