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Transport properties of an armchair carbon nanotube with a double vacancy under stretching
Z. Li; C. Y. Wang; X. Zhang; S. H. Ke; W. T. Yang
2008
发表期刊Journal of Physics-Condensed Matter
ISSN0953-8984
卷号20期号:34
摘要Structural properties of metallic single-walled carbon nanotubes with a double vacancy under stretching are studied by using a multiscale hybrid energy density method. Based on the optimized structure, the single-particle Green function method is then used to investigate the transport property. It is found that a reconstruction of the structure occurs with an increase of the imposed axial force, which alters the transmission function around the Fermi energy and will reduce the current. This reconstruction cannot be found by running a molecular dynamics simulation without a quantum description.
部门归属[li, zi; wang, chong-yu; zhang, xu] tsinghua univ, dept phys, beijing 100084, peoples r china. [wang, chong-yu] chinese acad sci, int ctr mat phys, shenyang 110016, peoples r china. [ke, san-huang; yang, weitao] duke univ, dept chem, durham, nc 27708 usa.;li, z (reprint author), tsinghua univ, dept phys, beijing 100084, peoples r china;lizi@mails.tsinghua.edu.cn
关键词Electronic-structure Conductance Irradiation Graphene Systems Tubules Energy
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WOS记录号WOS:000258317600028
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被引频次:4[WOS]   [WOS记录]     [WOS相关记录]
文献类型期刊论文
条目标识符http://ir.imr.ac.cn/handle/321006/32912
专题中国科学院金属研究所
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Z. Li,C. Y. Wang,X. Zhang,et al. Transport properties of an armchair carbon nanotube with a double vacancy under stretching[J]. Journal of Physics-Condensed Matter,2008,20(34).
APA Z. Li,C. Y. Wang,X. Zhang,S. H. Ke,&W. T. Yang.(2008).Transport properties of an armchair carbon nanotube with a double vacancy under stretching.Journal of Physics-Condensed Matter,20(34).
MLA Z. Li,et al."Transport properties of an armchair carbon nanotube with a double vacancy under stretching".Journal of Physics-Condensed Matter 20.34(2008).
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