Structural, electronic, optical and mechanical properties of InP alloyed with Zn, Si, Sn and S under pressure: First-principles calculation

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• 作者：Prayoonsak Pluengphon^a ; ^c ; ^{prayoonsak@gmail.com} ; Thiti Bovornratanaraks^b ; ^c ; ^{thiti.b@chula.ac.th} ; Udomsilp Pinsook^b ; ^c
• 关键词：Phase stability ; Elastic properties ; InP alloys ; High pressure ; Ab initio method
• 刊名：Journal of Alloys and Compounds
• 出版年：2017
• 出版时间：5 April 2017
• 年：2017
• 卷：700
• 期：Complete
• 页码：98-105
• 全文大小：2353 K
• 卷排序：700

文摘

The spontaneous process of InP alloys can be occurred in RS more than in ZB. (In,Zn)P has the strongest sharing electrons when compared with other InP alloys. The dielectric performance is reduced by the alloying effect, and transformed to conductor as high frequencies. Photoabsorption of InP alloys in ZB decreases under high pressure, while it increases in RS. Ductility of InP is induced by the Zn, Si, Sn and S substitutions.