Structure and reducibility of yttrium-doped cerium dioxide nanoparticles and (111) surface

Using periodic density functional calculations, we studied the local structure and preferred locations of yttrium cations and oxygen vacancies in Y-doped cerium dioxide. We employed three kinds of models – a slab of the CeO(2)(111) surface and two ceria nanoparticles of different sizes and shapes. I...

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Detalles Bibliográficos
Autores principales: Aleksandrov, Hristiyan A., Koleva, Iskra Z., Neyman, Konstantin M., Tabakova, Tatyana T., Vayssilov, Georgi N.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2018
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9467279/
https://www.ncbi.nlm.nih.gov/pubmed/36188438
http://dx.doi.org/10.1039/c8ra07014h

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9467279/
https://www.ncbi.nlm.nih.gov/pubmed/36188438
http://dx.doi.org/10.1039/c8ra07014h

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