First-principles study of structural, electronic, and optical properties of cubic In AsNP1-- triangular quaternary alloys

• Published in: 中国物理B：英文版 Vol. 26; no. 1; pp. 425 - 432
• Main Author: I Hattabi A Abdiche F Soyalp R Moussa R Riane K Hadji S Bin-Omran R Khenata
• Format: Journal Article
• Language: English
• Published: 2017
• Subjects: 三角; 光学性质; 全势线性缀加平面波; 四元合金; 密度泛函理论; 电子结构; 立方; 第一性原理

In this paper, we investigated the structural, electronic and optical properties of InAs, InN and InP binary compounds and their related ternary and quaternary alloys by using the full potential linearized augmented plane wave（FP-LAPW）method based on density functional theory（DFT）. The total energie...