Calculation of the structural and electronic properties of III-V semiconductor compounds using advanced functionals of density functional theory

In this study, the structural and electronic properties of III-V semiconductor compounds are studied using Density Functional Theory computations within the Full Potential Linearized Augmented Plane Wave (FP-LAPW) method. After considering several exchange-correlation functionals, it is determined t...

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Bibliographic Details
Main Authors: A M Nikoo, H Sadeghi, A Arab, S J Hashemifar
Format: Article
Language:English
Published: Isfahan University of Technology 2020-05-01
Series:Iranian Journal of Physics Research
Subjects:
dft
Online Access:http://ijpr.iut.ac.ir/article_1592_671c46a2245ff9c9ce1d8d9afc498f5a.pdf