• Acta Optica Sinica
  • Vol. 26, Issue 8, 1203 (2006)
[in Chinese]1、2、*, [in Chinese]2, [in Chinese]2, and [in Chinese]2
Author Affiliations
  • 1[in Chinese]
  • 2[in Chinese]
  • show less
    DOI: Cite this Article Set citation alerts
    [in Chinese], [in Chinese], [in Chinese], [in Chinese]. First-Principles Calculation of Electronic Structure and Optical Properties of ZnO[J]. Acta Optica Sinica, 2006, 26(8): 1203 Copy Citation Text show less
    References

    [1] Br M, J. Reichardt, A.Grimm et al.. Zn(O,OH) layers in chalcopyrite thin-film solar cells: Valence-band maximum versus composition[J]. J. Appl. Phys., 2005, 98(5): 053702-1~053702-8

    [2] Hyun-Jin Kim, Ho-Nyeon Lee, Jae-Chel Park et al.. The mechanism of improvement of contact resistivity in TFT-LCDs between IZO layers and Al-based metal lines by diffusion of Mo atoms[J]. Curr. Appl. Phys., 2002, 2(6): 451~454

    [4] Rui Jinhong, Jiand Dashao, Hong Bohe et al.. Effects of oxygen partial pressure on optical absorption edge and UV emission energy of ZnO films[J]. Chin. Opt. Lett., 2005, 3(7): 428~431

    [7] M. D. Segall, J. D. Philip Lindan, M. J. Probert et al.. First-principles simulation: ideas, illustrations and the castep code[J]. J. Phys .Cond. Matt., 2002, 14(11): 2717~2744

    [9] U. Rssler. Energy bands of hexagonal Ⅱ-Ⅵ semiconductors[J]. Phys. Rev., 1969, 184(3): 733~738

    [10] Yong-Nian Xu, Ching W Y. Electronic, optical, and structure properties of some wurtzite crystals[J]. Phys. Rev. B, 1993, 48(7): 4335~4351

    [11] Andrea Dal Corso, Michel Posternak, Raffaele Resta et al.. An initio study of piezoelectricity and spontaneous polarization in ZnO[J]. Phys. Rev. B, 1994, 50(15): 10715~10719

    [13] W. Y. Ching, Yongnian Xu, K. W. Wong. Ground-state and optical properties of Cu2O and CuO cryatals[J]. Phys. Rev. B, 1998, 40(11): 7684~7695

    [14] R. L. Hengehold, R. J. Almassy, F. L. Pedrotti. Electron energy-loss and ultraviolet-refletivity spectra of crystalline ZnO[J]. Phys. Rev. B, 1970, 1(12): 4784~4790

    [15] John L. Freeouf. Far-ultraviolet reflectance of Ⅱ-Ⅵ compounds and correlation with the penn-phillips gap[J]. Phys. Rev. B, 1973, 7(8): 3810~3830

    [16] R. L. Hengehold, F. L. Pedrotti. Plasmon excitation energies in ZnO, CdO and MgO[J]. J. Appl. Phys., 1976, 47(1): 287~291

    [17] H. C. Ong, J. Y. Dai, G. T. Du. Studies of electronic structure of ZnO grain boundary and its proximity by using spatially resolved electron energy loss spectroscopy[J]. Appl. Phys. Lett., 2002, 81(2): 277~279

    [18] S. J. Pearton, D. P. Norton, K. Ip et al.. Recent progress in processing and properties of ZnO[J]. Progress in Materials Science, 2005, 50(3): 293~340

    [19] R. Matz, H. Lǔ. Ellipsometric spectroscopy of the ZnO nonpolar (1100) surface[J]. Appl. Phys., 1979, 18(4): 123~130

    [20] K. Postava, H. Sueki, M. Aoyama et al.. spectroscopic ellipsometry of epitaxial ZnO layer on sapphire substrate[J]. J. Appl. Phys., 2000, 87(11): 7820~7824

    [21] Hisashi Yoshikawa, Sadao Adachi. Optical constants of ZnO[J]. Jpn. J. Appl. Phys., 1997, 36(1): 6237~6243

    [22] Walter A. Harrison. Elcronic Structure and the Properties of Solids[M]. New York: Dover press, 1989. 121~160

    CLP Journals

    [1] Xiang Dong, Liu Bo, Gu Mu, Liu Xiaolin, Huang Shiming, Ni Chen. Theoretical Calculation of Electronic Structures and Optical Properties of YTaO4 and LuTaO4[J]. Acta Optica Sinica, 2009, 29(2): 448

    [2] Zhou Shiyun, Xie Quan, Yan Wanjun, Chen Qian. First-Principles Calculation of Electronic Structure and Optical Properties of CrSi2 with Doping Mn[J]. Acta Optica Sinica, 2009, 29(10): 2848

    [3] Li Enling, Ma Deming, Liu Mancang, Wang Xuewen. Research on Structure and Vibrational Frequency of GaN Neutral and Ion Clusters[J]. Acta Optica Sinica, 2009, 29(12): 3248

    [4] Li Huixue, Xu Hengxia, Li Zhifeng, Wang Xiaofeng, Dong Xiaoning, Yuan Kun, Zhu Yuancheng, Xiao Tai. Crystal Structure and Photoelectric Properties of 3-Phenyl-6-(4-Methylphenyl)-1,2,4-Triazolo[4,3-b]-1,2,4-Triazine[J]. Acta Optica Sinica, 2009, 29(1): 236

    [5] Shao Tingting, Zhang Fuchun, Cui Hongwei. Density Functional Theory Study on the Electronic Structure and Optical Properties of La,Ce and Nd doped SnO2[J]. Laser & Optoelectronics Progress, 2015, 52(9): 91602

    [6] Cui Hongwei, Zhang Fuchun, Shao Tingting. First-Principles Study on Electronic Structure and Optical Properties of Sn-Doped ZnO[J]. Acta Optica Sinica, 2016, 36(7): 716002

    [7] Cai Jianqiu, Tao Xiangming, Luo Haijun, Jin Qingli, Huang Yunmi. Ab-initio Investigation of Anisotropic Optical Properties of Sr2RuO4[J]. Acta Optica Sinica, 2010, 30(12): 3580

    [8] Shao Tingting, Zhang Fuchun, Cui Hongwei. Density Functional Theory Study on the Electronic Structure and Optical Properties of Sb-doped SnO2[J]. Laser & Optoelectronics Progress, 2015, 52(8): 81601

    [9] Zhang Yun, Shen Yue, Gu Feng, Zhang Jiancheng, Wang Linjun, Xia Yiben. Influence of Ions Doping on the Optical Properties of Mesoporous TiO2 thin Films[J]. Acta Optica Sinica, 2010, 30(6): 1841

    [10] Yan Wanjun, Zhou Shiyun, Xie Quan, Guo Benhua, Zhang Chunhong, Zhang Zhongzheng. Effect of Al Doping Concentration on Electronic and Optical Properties of CrSi2[J]. Acta Optica Sinica, 2012, 32(5): 516003

    [11] Yan Wanjun, Zhou Shiyun, Xie Quan, Gui Fang, Zhang Chunhong, Guo Xiaotian. First Principles Study of Electronic Structure and Optical Properties for Co-doped β-FeSi2[J]. Acta Optica Sinica, 2011, 31(6): 616003

    [12] Jiang Jianhui, Wu Kongping, Lu Kailin, Qi Jian, Peng Bo, Zhu Yanna. Effect of Intermediate-Band on the ZnO/ZnTe Photovoltaic Solar Cell[J]. Acta Optica Sinica, 2015, 35(9): 916003

    [13] Lin Jiaqi, Ni Haifang, Wang Chen, Lei Qingquan. Poly (Ethylene Terephthalate) Electronic Structural and Optical Propertie from First Principles Calculations[J]. Acta Optica Sinica, 2010, 30(11): 3239

    [in Chinese], [in Chinese], [in Chinese], [in Chinese]. First-Principles Calculation of Electronic Structure and Optical Properties of ZnO[J]. Acta Optica Sinica, 2006, 26(8): 1203
    Download Citation