Laser & Optoelectronics Progress, Volume. 55, Issue 4, 041601(2018)

Theoretical Calculation of Electronic Structure and Optical Properties of Two-Dimensional GaAs

Yujin Chu, Jinmin Zhang*, Tinghong Gao, Zean Tian, Yongchao Liang, Qian Chen, Zhongnian Huang, and Quan Xie
Author Affiliations
  • College of Big Data and Information Engineering, Guizhou University, Guiyang, Guizhou 550025, China
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    Figures & Tables(9)
    Graphene-like structure of two-dimensional (2D) GaAs. (a) Model in first-principle calculation; (b) model in molecular dynamics
    Phonon spectral curves of 2D GaAs
    Energy band structure. (a) 2D GaAs; (b) 3D GaAs
    (a) Total density of states of 2D and 3D GaAs ; (b) partial density of states of Ga; (c) partial density of states of As
    Complex dielectric function. (a) 2D GaAs; (b) 3D GaAs
    (a) Absorption and (b) reflection spectra of 2D and 3D GaAs
    Energy loss function spectra of 2D and 3D GaAs
    • Table 1. Energy value of highly symmetric point in 2D GaAs Brillouin zone

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      Table 1. Energy value of highly symmetric point in 2D GaAs Brillouin zone

      PointGAHKML
      E1 /eV-0.240.332.172.431.531.82
      E2 /eV-0.84-0.890.07-0.16-0.38-0.26
    • Table 2. Parameters of h-BN, MoS2 and BC2N

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      Table 2. Parameters of h-BN, MoS2 and BC2N

      Two-dimensional materialPermittivityBand gap /eVAbsorbed energy /eVαmax /cm-1Rmax
      h-BN4.94.424.21-7.6311467752%
      MoS24.31.81.55-8.00800005%
      BC2N5.004.35-22.1251000050%
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    Yujin Chu, Jinmin Zhang, Tinghong Gao, Zean Tian, Yongchao Liang, Qian Chen, Zhongnian Huang, Quan Xie. Theoretical Calculation of Electronic Structure and Optical Properties of Two-Dimensional GaAs[J]. Laser & Optoelectronics Progress, 2018, 55(4): 041601

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    Paper Information

    Category: Materials

    Received: Aug. 21, 2017

    Accepted: --

    Published Online: Sep. 11, 2018

    The Author Email: Jinmin Zhang (jmzhang@gzu.edu.cn)

    DOI:10.3788/LOP55.041601

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