Structural, energetic and electronic properties of intercalated boron-nitride nanotubes

被引：1
|
作者：
Rada, S. [1 ]
Rada, M. [2 ]
Culea, E. [1 ]
机构：
[1] Tech Univ Cluj Napoca, Dept Chem & Phys, Cluj Napoca 400020, Romania
[2] Natl Inst R&D Isotop & Mol Technol, Cluj Napoca 400293, Romania
来源：
BULLETIN OF MATERIALS SCIENCE | 2013年 / 36卷 / 02期
关键词：
Intercalated boron-nitride nanotubes; quantum chemical calculations; CARBON NANOTUBES;
D O I：
10.1007/s12034-013-0448-1
中图分类号：
T [工业技术];
学科分类号：
08 ;
摘要：
The effects of chirality and the intercalation of transitional metal atoms inside single walled BN nanotubes on structural, energetic and electronic properties have been considered in this paper. The thermodynamic stability of BN nanotubes can be improved by the intercalation of cobalt or nickel. BN nanotubes can behave like an ideal non-interacting hosts for these one-dimensional chains of metal atoms. Their electronic properties are insignificantly modified.
引用
收藏
页码：189 / 191
页数：3
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