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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:
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