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Influence of Ch substitution on structural, electronic, and thermoelectric properties of layered oxychalcogenides (La(0.5)Bi(0.5)O)CuCh (Ch = S, Se, Te): a new insight from first principles

We study the structural, electronic, and thermoelectric properties of p-type layered oxychalcogenides (La(0.5)Bi(0.5)O)CuCh (Ch = S, Se, Te) from first principles. Ch substitution from S to Te enhances the local-symmetry distortions (LSDs) in CuCh(4) and OLa(2)Bi(2) tetrahedra, where the LSD in OLa(...

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Detalles Bibliográficos
Autores principales:	Muhammady, Shibghatullah, Widita, Rena, Darma, Yudi
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2020
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9055621/ https://www.ncbi.nlm.nih.gov/pubmed/35516961 http://dx.doi.org/10.1039/d0ra05187j

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