Article ID Journal Published Year Pages File Type
1546725 Physica E: Low-dimensional Systems and Nanostructures 2007 4 Pages PDF
Abstract

In this paper we use ab initio density functional theory (DFT) to calculate the electronic transport properties of the endohedral fullerene N@C60N@C60 encapsulated within (n,m)(n,m) single-walled carbon nanotubes (SWNTs) to produce carbon nanotube peapods (CNPs). By comparing the electronic properties of C60@(n,m)C60@(n,m) and N@C60@(n,m)N@C60@(n,m) CNPs, we demonstrate that due to the inertness of the inner surface of the C60C60 cage, the nitrogen is very well protected from its environment.

Related Topics
Physical Sciences and Engineering Materials Science Electronic, Optical and Magnetic Materials
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