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ACS Physical Chemistry Au
(Nov 2021)
Computational Screening of First-Row Transition-Metal Based Alloy CatalystsLigand Induced N2 Reduction Reaction Selectivity
Arunendu Das,
Shyama Charan Mandal,
Akhil S. Nair,
Biswarup Pathak
Affiliations
Arunendu Das
Department of Chemistry, Indian Institute of Technology Indore, Indore, India
Shyama Charan Mandal
Department of Chemistry, Indian Institute of Technology Indore, Indore, India
Akhil S. Nair
Department of Chemistry, Indian Institute of Technology Indore, Indore, India
Biswarup Pathak
Department of Chemistry, Indian Institute of Technology Indore, Indore, India
DOI
https://doi.org/10.1021/acsphyschemau.1c00021
Journal volume & issue
Vol. 2, no. 2
pp. 125 – 135
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