Screening of transition metal single-atom catalysts supported by a WS<sub>2</sub> monolayer for electrocatalytic nitrogen reduction reaction: insights from activity trend and descriptor

Renyi Li; Wei Guo

doi:10.1039/d2cp01446g

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Screening of transition metal single-atom catalysts supported by a WS₂ monolayer for electrocatalytic nitrogen reduction reaction: insights from activity trend and descriptor

Renyi Li Wei Guo

Year: 2022 Journal: Physical Chemistry Chemical Physics Vol: 24 (21)Pages: 13384-13398 Publisher: Royal Society of Chemistry

DOI: 10.1039/d2cp01446g

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Abstract

The constructed activity trend and the identified descriptor of the nitrogen reduction reaction provide comprehensive insights for transition metal single-atom catalysts supported by WS 2 monolayer.

Keywords:

Chemistry Catalysis Monolayer Adsorption Selectivity Transition metal Rate-determining step Redox Ammonia production Photochemistry Inorganic chemistry Physical chemistry Organic chemistry

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Ammonia Synthesis and Nitrogen Reduction

Physical Sciences → Chemical Engineering → Catalysis

Advanced Photocatalysis Techniques

Physical Sciences → Energy → Renewable Energy, Sustainability and the Environment

Electrocatalysts for Energy Conversion

Physical Sciences → Energy → Renewable Energy, Sustainability and the Environment

Screening of transition metal single-atom catalysts supported by a WS₂ monolayer for electrocatalytic nitrogen reduction reaction: insights from activity trend and descriptor

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