by Koltai, J, Rusznyák, Á, Zólyomi, V, Kürti, J and László, I
Abstract:
Single walled carbon nanotubes can be used as nanoscale reaction chambers for producing smaller nanotubes within the host tube from encapsulated fullerenes by annealing. The diameter of the host outer tube restricts the diameter of the inner tube due to van der Waals interactions, but not chirality; however, only a few chiralities are allowed for any given outer tube diameter. It is possible that inner tubes with different chiralities - or the same chirality but left- and right-handedness - can start to grow in different places at the same time. A straight junction occurs at the connection of these two tubes. The geometry of different kinds of junctions containing pentagon and heptagon defects was optimized by density functional theory. The effect of the localized states on the electronic band structure was investigated. Geometry of our (6,4) nanobamboo from two points of view. The pentagon and heptagon defects are highlighted. (C) 2009 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim
Reference:
Junctions of left- and right-handed chiral carbon nanotubes nanobamboo (Koltai, J, Rusznyák, Á, Zólyomi, V, Kürti, J and László, I), In Physica Status Solidi B-Basic Solid State Physics, volume 246, 2009.
Bibtex Entry:
@article{ ISI:000272904100060,
author = {Koltai, J and Rusznyák, Á and Zólyomi, V and Kürti, J
and László, I},
title = {Junctions of left- and right-handed chiral carbon nanotubes nanobamboo},
journal = {Physica Status Solidi B-Basic Solid State Physics},
year = {2009},
volume = {246},
number = {11-12, Sp. Iss. SI},
pages = {2671-2674},
month = {DEC},
abstract = {Single walled carbon nanotubes can be used as nanoscale reaction
chambers for producing smaller nanotubes within the host tube from
encapsulated fullerenes by annealing. The diameter of the host outer
tube restricts the diameter of the inner tube due to van der Waals
interactions, but not chirality; however, only a few chiralities are
allowed for any given outer tube diameter. It is possible that inner
tubes with different chiralities - or the same chirality but left- and
right-handedness - can start to grow in different places at the same
time. A straight junction occurs at the connection of these two tubes.
The geometry of different kinds of junctions containing pentagon and
heptagon defects was optimized by density functional theory. The effect
of the localized states on the electronic band structure was
investigated.
Geometry of our (6,4) nanobamboo from two points of view. The pentagon
and heptagon defects are highlighted. (C) 2009 WILEY-VCH Verlag GmbH \&
Co. KGaA, Weinheim},
keywords = {DFT ; DOS ; Nanobamboo ; Geometry},
doi = {10.1002/pssb.200982328},
issn = {0370-1972},
unique-ID = {ISI:000272904100060},
}