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Theoretical Screening of Single Transition Metal Atoms Embedded in MXene Defects as Superior Electrocatalyst of Nitrogen Reduction Reaction

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Year: 2019
Type: article
Source: Small Methods
DOI: 10.1002/smtd.201900337
Authors: Lei Li, Xingyong Wang, Haoran Guo, Ge Yao, Haibo Yu, Ziqi Tian, Baihai Li, Liang Chen
Institutions: University of Electronic Science and Technology of China, Chinese Academy of Sciences, University of Chinese Academy of Sciences, Ningbo Institute of Industrial Technology, University of Wollongong, Collaborative Innovation Center of Advanced Microstructures, National Laboratory of Solid State Microstructures, Nanjing University
Language: English

Topic: Ammonia Synthesis and Nitrogen Reduction
Subfield: Catalysis
Field: Chemical Engineering
Domain: Physical Sciences
SDG: Affordable and clean energy

Open Access status: closed

Funders: National Natural Science Foundation of China, Australian Research Council, National Key Research and Development Program of China
Awards: Computational enzymology: exploring the free energy landscape of enzymatic catalysis, G4096362481, G7981549944
OpenAlex ID: W2954286745
FWCI: 7.984
Cites: 61
Cited by: 293
Related to: 10
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