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中国物理学会期刊

含有五边形—七边形缺陷的单壁纳米碳管的输运性质研究

CSTR: 32037.14.aps.55.4822

Electronic transport properties of single-wall carbon nanotube with pentagon-heptagon-pair defect

CSTR: 32037.14.aps.55.4822
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  • 运用第一性原理的密度泛函理论结合非平衡格林函数研究了含有五边形—七边形拓扑缺陷的纳米碳管异质结的输运性质.结果发现:拓扑缺陷对碳管的输运性质有很大影响;另外,不同类型的碳管形成的异质结的输运性质也有明显的差异.

     

    Using the density-functional theory in combination with nonequilibrium Green's function technique, we studied the densities of states and transport properties of the(7,0)—(8,0)and(8,0)—(9,0)single-wall carbon-nanotube heterojunctions containing one pentagon-heptagon-pair (5/7) topological defect. The result suggests that the effect of pentagon-heptagon-pairs (5/7) topological defects on carbon nanotubes is remarkable.In addition, the heterojunctions constituted by different types of carbon nanotubes also have different characteristics.

     

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