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First-principles calculations of the structural and electronics properties of YInN alloy

We study the structural and electronic properties of YxIn1-xN in the concentrations x = 0, ¼, ½, –, and 1 in the B1, B2, B3, and B4 structures. The calculations show that for Y0.75In0.25N, the B1 structure is the most energetically favorable. It was determined that between 0<x<~0.12 in the (1×...

Disgrifiad llawn

Wedi'i Gadw mewn:
Manylion Llyfryddiaeth
Cyhoeddwyd yn:Dyna
Prif Awduron: G. Patricia Abdel Rahim-Garzón, Jairo Arbey Rodríguez-Martínez, María Guadalupe Moreno-Armenta, Miguel José Espitia-Rico
Fformat: Artigo
Iaith:Inglês
Cyhoeddwyd: Universidad Nacional de Colombia 2021
Pynciau:
xN
DFT
Mynediad Ar-lein:https://www.redalyc.org/articulo.oa?id=49671281006
https://www.redalyc.org/journal/496/49671281006/
https://www.redalyc.org/journal/496/49671281006/html/
https://www.redalyc.org/journal/496/49671281006/49671281006.epub
https://www.redalyc.org/journal/496/49671281006/movil
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