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Regulation of monolayer MgGeN2 thin film with uniaxial and biaxial strain
Yu, Yi1; Chen, Kai1; Chang, Xiangrong1; Ma, Xiumin2; Pan, Min3; Chu, Longsheng1; Hu, Chunfeng1; Feng, Qingguo1
2024-06-01
发表期刊PHYSICA SCRIPTA
ISSN0031-8949
卷号99期号:6页码:7
通讯作者Feng, Qingguo([email protected])
摘要The regulation of electronic and optical properties with uniaxial and biaxial strain is computationally investigated for the monolayer thin film of a newly discovered quasi-layered MgGeN2 phase. It is found that, under uniaxial compression in both [100] and [010] directions with the perpendicular lattice parameter relaxable, the band gap will first increases and then decreases, while under uniaxial tensile strain the band gap decreases monotonically and the light absorption in the visible region is strongly enhanced. When uniaxial compression was applied with the perpendicular lattice constant fixed, the band gap behaves like the first kind of uniaxial compression and the light absorption is enhanced in visible range by compression. When biaxial strain was applied, the band gap shows a monotonic decrease from the largest compression down to the largest tensile strain, while the light absorption behaves in the opposite way. Therefore, the band structure and light absorption of monolayer MgGeN2 can be efficiently tuned with strain and stress, which can potentially be used for the MgGeN2 film in device design, thus promoting its applications in optoelectronics and photocatalysis.
关键词ternary nitrides thin film strain electronic structure optical properties first principles
DOI10.1088/1402-4896/ad492b
收录类别SCI
语种英语
资助项目Sichuan Science and technology program[2022YFH0089]; Tianfu eMei Science and Technology innovation Leader Program in Sichuan Province; Southwest Jiaotong University[2019KY23]
WOS研究方向Physics
WOS类目Physics, Multidisciplinary
WOS记录号WOS:001228387500001
出版者IOP Publishing Ltd
WOS关键词1ST-PRINCIPLES
引用统计
被引频次:2[WOS]   [WOS记录]     [WOS相关记录]
文献类型期刊论文
条目标识符http://ir.qdio.ac.cn/handle/337002/185905
专题中国科学院海洋研究所
通讯作者Feng, Qingguo
作者单位1.SouthwestJiaotong Univ, Sch Mat Sci & Engn, Key Lab Adv Technol Mat, Minist Educ, Chengdu 610031, Sichuan, Peoples R China
2.Inst Oceanol, Chinese Acad Sci, Qingdao 266071, Shandong, Peoples R China
3.Southwest Jiaotong Univ, Sch Elect Engn, Chengdu, Sichuan, Peoples R China
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GB/T 7714
Yu, Yi,Chen, Kai,Chang, Xiangrong,et al. Regulation of monolayer MgGeN2 thin film with uniaxial and biaxial strain[J]. PHYSICA SCRIPTA,2024,99(6):7.
APA Yu, Yi.,Chen, Kai.,Chang, Xiangrong.,Ma, Xiumin.,Pan, Min.,...&Feng, Qingguo.(2024).Regulation of monolayer MgGeN2 thin film with uniaxial and biaxial strain.PHYSICA SCRIPTA,99(6),7.
MLA Yu, Yi,et al."Regulation of monolayer MgGeN2 thin film with uniaxial and biaxial strain".PHYSICA SCRIPTA 99.6(2024):7.
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