Structures and electronic properties of small carbon nanotube tori

被引:68
作者
Oh, DH
Park, JM
Kim, KS [1 ]
机构
[1] Natl Creat Res Initiat Ctr Superfunct Mat, Pohang 790784, South Korea
[2] Pohang Univ Sci & Technol, Dept Chem, Pohang 790784, South Korea
来源
PHYSICAL REVIEW B | 2000年 / 62卷 / 03期
关键词
D O I
10.1103/PhysRevB.62.1600
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Fullerenes and nanotubes are promising candidates in the development of nanodevices. Recently, a form of carbon nanotube torus structures has been observed. In this regard, we have investigated the geometries, electronic structures, and energetics of small carbon nanotube tori, using both the tight-binding and semiempirical quantum chemical approaches. It is shown that D-5d nanotube tori behave like semiconductors, while D-6h nanotube tori exhibit metal (or metal-like) characteristics similar to bent nanotubes. We show that the D-5d nanotube tori, which are as stable as the corresponding fullerenes, are energetically more favored than the corresponding nanotubes. In particular, the pentagons of the D-5d nanotube tori are less deformed than those of bent nanotubes and D-6h nanotube tori. This indicates that such small nanotube tori could be observed under optimal kinetic-driven conditions and eventually utilized as nanodevices.
引用
收藏
页码:1600 / 1603
页数:4
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