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First-principles investigation on the segregation of Pd at LaFe(1-x)Pd(x)O(3-y) surfaces

First-principles calculations were performed to investigate the effect of Pd concentration and oxygen vacancies on the stability of Pd at LaFeO(3) surfaces. We found a much stronger tendency of Pd to segregate by taking the aggregation of Pd at LaFe(1-x)Pd(x)O(3-y) surfaces into consideration, resul...

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Detalles Bibliográficos
Autores principales:	Tian, Zhi-xue, Uozumi, Akifumi, Hamada, Ikutaro, Yanagisawa, Susumu, Kizaki, Hidetoshi, Inagaki, Kouji, Morikawa, Yoshitada
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Springer 2013
Materias:	Nano Express
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3848295/ https://www.ncbi.nlm.nih.gov/pubmed/23634933 http://dx.doi.org/10.1186/1556-276X-8-203

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