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Adsorption of NO(x) (x = 1, 2) Molecules on the CoFeMnSi(001) Surface: First-Principles Insights

[Image: see text] In this article, the adsorption of NO(x) (x = 1, 2) gas molecules on the (001) surface of CoFeMnSi quaternary Heusler alloys has been investigated theoretically with density functional theory (DFT) calculations. The adsorption strength was estimated with adsorption energy (E(a)), m...

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Detalles Bibliográficos
Autores principales:	Mushtaq, Muhammad, Algethami, Norah, Abdul Rauf Khan, Muhammad, Ayesh, Ahmad I., Mateen, Muhammad, Laref, Amel, Abdelmohsen, Shaimaa A. M., Hossain, M. Khalid
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2023
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10116634/ https://www.ncbi.nlm.nih.gov/pubmed/37091401 http://dx.doi.org/10.1021/acsomega.3c00569

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