Optoelectronic and mechanical properties of gallium arsenide alloys: Based on density functional theory
First principles calculations based on density functional theory (DFT) were performed to investigate the structural, electronic, optical and mechanical properties of pristine GaAs compound and its alloy; Ga0.75Al0.25As, Ga0.75In0.25As, Ga0.75Sn0.25As, Ga0.75Ti0.25As. WIEN2K and Quantum expresso (QE)...
Main Authors: | , , , , , , , , |
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Format: | Article |
Language: | English |
Published: |
Elsevier
2024-06-01
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Series: | Chemical Physics Impact |
Subjects: | |
Online Access: | http://www.sciencedirect.com/science/article/pii/S2667022424001385 |