Physics – Condensed Matter – Materials Science
Scientific paper
2005-11-09
Appl. Phys. Lett. 87, 243133 (2005)
Physics
Condensed Matter
Materials Science
To be published in Appl. Phys. Lett
Scientific paper
10.1063/1.2142290
The structural and electronic properties of fluorine (F)-doped BN nanotubes (BNNTs) are studied using density functional methods. Our results indicate that F atoms prefer to substitute N atoms, resulting in substantial changes of BN layers. However, F substitutional doping results in no shallow impurity states. The adsorption of F atoms on B sites is more stable than that on N sites. BNNTs with adsorbed F atoms are p-type semiconductors, suggesting the electronic conduction in F-doped multiwalled BNNTs with large conductivity observed experimentally might be of p-type due to the adsorbed F atoms, but not n-type as supposed before.
Hou Jian Guo
Xiang H. J.
Yang Jinlong
Zhu Qingshi
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