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Adsorption and Oxidation of CO on Ceria Nanoparticles Exposing Single-Atom Pd and Ag: A DFT Modelling

Various CO(x) species formed upon the adsorption and oxidation of CO on palladium and silver single atoms supported on a model ceria nanoparticle (NP) have been studied using density functional calculations. For both metals M, the ceria-supported MCO(x) moieties are found to be stabilised in the ord...

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Detalles Bibliográficos
Autores principales:	Nasluzov, Vladimir A., Ivanova-Shor, Elena A., Shor, Aleksey M., Laletina, Svetlana S., Neyman, Konstantin M.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2021
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8618484/ https://www.ncbi.nlm.nih.gov/pubmed/34832290 http://dx.doi.org/10.3390/ma14226888

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