Structural, electronic, and optical properties of wurtzite and rocksalt InN under pressure

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	Structural, electronic, and optical properties of wurtzite and rocksalt InN under pressure
	M. Y. Duan; L. He; M. Xu; M. Y. Xu; S. Y. Xu; K. Ostrikov
	2010
发表期刊	Physical Review B
ISSN	1098-0121
卷号	81 期号:3
摘要	Structural stability, electronic, and optical properties of InN under high pressure are studied using the first-principles calculations. The lattice constants and electronic band structure are found consistent with the available experimental and theoretical values. The pressure of the wurtzite-to-rocksalt structural transition is 13.4 GPa, which is in an excellent agreement with the most recent experimental values. The optical characteristics reproduce the experimental data thus justifying the feasibility of our theoretical predictions of the optical properties of InN at high pressures.
部门归属	[duan, man-yi; he, lin; xu, ming] sichuan normal univ, inst solid state phys, chengdu 610068, peoples r china. [xu, ming] cas, int ctr mat phys, shenyang 110016, peoples r china. [duan, man-yi; xu, ming-yao] wuhan univ sci & engn, sch sci, wuhan 430073, peoples r china. [xu, shuyan] nanyang technol univ, natl inst educ, singapore 637616, singapore. [ostrikov, kostya (ken)] csiro mat sci & engn, lindfield, nsw 2070, australia. [ostrikov, kostya (ken)] univ sydney, sch phys, sydney, nsw 2006, australia.;xu, m (reprint author), sichuan normal univ, inst solid state phys, chengdu 610068, peoples r china;hsuming_2001@yahoo.com.cn
关键词	Density-functional Theory Iii-v Nitrides Indium Nitride Stability Energy Gap
URL	查看原文
WOS记录号	WOS:000274002300002
引用统计	被引频次：17[WOS] [WOS记录] [WOS相关记录]
文献类型	期刊论文
条目标识符	http://ir.imr.ac.cn/handle/321006/31085
专题	中国科学院金属研究所
推荐引用方式 GB/T 7714	M. Y. Duan,L. He,M. Xu,et al. Structural, electronic, and optical properties of wurtzite and rocksalt InN under pressure[J]. Physical Review B,2010,81(3).
APA	M. Y. Duan,L. He,M. Xu,M. Y. Xu,S. Y. Xu,&K. Ostrikov.(2010).Structural, electronic, and optical properties of wurtzite and rocksalt InN under pressure.Physical Review B,81(3).
MLA	M. Y. Duan,et al."Structural, electronic, and optical properties of wurtzite and rocksalt InN under pressure".Physical Review B 81.3(2010).