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First-principles study of electronic and optical properties of BGaAs alloy

  • 【作者】Yan, Yingce,Wang, Yanlong,Ma, Huifang
  • 【刊名】Jisuan Wuli/Chinese Journal of Computational Physics
  • 【作者单位】aDepartment of Physics, Taiyuan Normal University, Taiyuan, 030031, China;bShanxi University, Taiyuan, 030006, China
  • 【年份】2016
  • 【卷号】Vol.33 No.2
  • 【页码】221-228
  • 【ISSN】1001-246X
  • 【关键词】Boron Electronic structure First-principles Optical property 
  • 【摘要】 First-principles calculations based on density functional theory are performed for zinc-blende BGaAs alloy with a special quasirandom structure approach in a 64-atom supercell. Structural, electronic and optical properties of BGaAs alloy are compreh...
  • 【文献类型】 期刊
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