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Rare Metals
Erschienen in: Rare Metals 8/2020

23.06.2020

Ru-doped phosphorene for electrochemical ammonia synthesis

verfasst von: Jian-Dong Liu, Zeng-Xi Wei, Yu-Hai Dou, Yue-Zhan Feng, Jian-Min Ma

Erschienen in: Rare Metals | Ausgabe 8/2020

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Abstract

The electrochemical ammonia synthesis has attracted increasing attention due to its energy saving characteristics. However, developing novel electrocatalysts and their mechanism remain great challenges. Here, several transition metal (TM) atoms doped on phosphorene were studied as N2 fixation electrocatalysts by using density functional theory (DFT) calculations. The results demonstrate that single Ru atom doped phosphorene shows an excellent catalytic activity for ammonia synthesis via the enzymatic pattern. A small overpotential of 0.696 V is achieved for this process. The effect of oxidation in the catalyst was also discussed in our work. Oxidation deactivates the catalyst, which should be avoided in the experiment. Our outcomes offer a novel perspective for single-atom catalytic ammonia synthesis with phosphorene as a substrate.

Graphic abstract

Vorheriger Artikel NaV3O8/poly(3,4-ethylenedioxythiophene) composites as high-rate and long-lifespan cathode materials for reversible sodium storage
Nächster Artikel Enhancing photothermal CO2 catalysis by thermal insulating substrates

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Metadaten
Titel
Ru-doped phosphorene for electrochemical ammonia synthesis
verfasst von
Jian-Dong Liu
Zeng-Xi Wei
Yu-Hai Dou
Yue-Zhan Feng
Jian-Min Ma
Publikationsdatum
23.06.2020
Verlag
Nonferrous Metals Society of China
Erschienen in
Rare Metals / Ausgabe 8/2020
Print ISSN: 1001-0521
Elektronische ISSN: 1867-7185
DOI
https://doi.org/10.1007/s12598-020-01451-z

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