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Exploring Exemplary Optoelectronic and Charge Transport Properties of KCuX(X=Se,Te)

We report the electronic structure, optical and charge transport properties of the unexplored ternary Zintl phases KCuX(X=Se,Te) from the first principles calculations employing the full-potential linearized augmented plane-wave (FLAPW) method with the Tran Blaha modified Becke-Johnson (TBmBJ) poten...

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Detalles Bibliográficos
Autores principales: Parveen, Atahar, Vaitheeswaran, G.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6117315/
https://www.ncbi.nlm.nih.gov/pubmed/30166554
http://dx.doi.org/10.1038/s41598-018-31300-0