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Electronic transport signatures of common defects in irradiated graphene-based systems

机译:基于辐照石墨烯的系统中常见缺陷的电子传输特征

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Ion irradiation of a graphene sheet can give rise to a wide range of point and extended defects on the ideal honeycomb lattice. Here we perform first-principles calculations for the determination of the electronic and transport properties of damaged graphene nanoribbons based on nonequilibrium Green function techniques. Considering a wide range of defects (vacancies, di-vacancies, Stone-Wales, sp~3-type) we study the conductive characteristics, showing that the common feature in all cases is the presence of transport gaps induced by local perturbations of the wavefunction around the defected areas. However, the resonances of these pseudogaps are intrinsically related to the defect type, making possible a struc tural characterization of a defected graphene system based on its electrical behavior.
机译:石墨烯片的离子辐照会在理想的蜂窝状晶格上产生宽范围的点和扩展的缺陷。在这里,我们基于非平衡格林函数技术执行第一性原理计算,以确定受损的石墨烯纳米带的电子和传输性能。考虑到各种各样的缺陷(空位,双空位,Stone-Wales,sp〜3型),我们研究了导电特性,显示出在所有情况下的共同特征是由波函数的局部扰动引起的传输间隙的存在在缺陷区域周围。然而,这些伪间隙的共振与缺陷类型本质上相关,从而使得基于缺陷石墨烯系统的电性能进行结构表征成为可能。

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