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Effect of normal strain and external electric field on electronic properties of the GeC bilayer: A first-principles study

机译:正常应变与外电场对GEC双层电子特性的影响:一项研究

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The electronic properties of the GeC bilayer with different stacking patterns are investigated using density functional theory. A different behavior shows up when applying normal strain and electric field (E-field). Under normal strain, the bandgap becomes very elastic and presents an indirect-to-direct bandgap transition. By applying the E-field, the intrinsic bandgap swiftly reduces to zero. The major modulation of the bandgap is mainly due to the migration of Ge-p orbitals in the conduction band. Our results reveal the flexible electronic properties of the GeC bilayer, which would provide a theoretical reference for the development of the GeC bilayer.
机译:使用密度函数理论研究了GEC双层具有不同堆叠图案的电子特性。在施加正常应变和电场(E场)时,不同的行为出现。在正常应变下,带隙变得非常弹性并且呈现间接到直接的带隙转变。通过应用E字段,内在的带隙迅速减小到零。带隙的主要调制主要是由于导通带中的GE-P轨道迁移。我们的结果揭示了GEC双层的灵活电子特性,这将为GEC双层的发展提供理论参考。

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