探索Cd0.50Zn0.50Se合金的压力诱导光电响应

IF 2.5 3区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY
Muhammad Aamir Iqbal, Sadia Zafar and Kareem Morsy
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引用次数: 0

摘要

本文利用密度泛函理论研究了Cd0.50Zn0.50Se合金在0 ~ 100 GPa压力下的光电响应。加入压力显著影响了电子和光学特性,从0到50 GPa的压力增加使带隙能量从2.19 eV增加到3.03 eV。观察到合金的线性吸收系数覆盖了可见光到紫外区的宽光谱,这是由于通过改变压力而发生的光学和电子跃迁。观察到静态折射率和静态介电常数的增加。其他光学参数,如光电导率、消光系数、能量损失函数和反射,也作为压力的函数进行了研究。这些材料有望用于设计压力传感装置。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Exploring the pressure-induced optoelectronic response of the Cd0.50Zn0.50Se alloy

Exploring the pressure-induced optoelectronic response of the Cd0.50Zn0.50Se alloy

This study focuses on the optoelectronic response of the Cd0.50Zn0.50Se alloy using density functional theory at varying pressures ranging from 0 to 100 GPa. Incorporating pressure significantly impacted the electronic and optical characteristics and an increase in pressure from 0 to 50 GPa yields an increase in the bandgap energy from 2.19 to 3.03 eV. The linear absorption coefficient of the alloy is observed to cover the broad light spectrum in the visible to ultraviolet regions due to optical and electronic transitions occurring by changing the pressure. An increase in static refractive index and static dielectric constant is observed. The other optical parameters, such as optical conductivity, extinction coefficient, energy loss function, and reflection, are also studied as a function of pressure. These materials are anticipated to be used in designing pressure-sensing devices.

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来源期刊
New Journal of Chemistry
New Journal of Chemistry 化学-化学综合
CiteScore
5.30
自引率
6.10%
发文量
1832
审稿时长
2 months
期刊介绍: A journal for new directions in chemistry
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