88 research outputs found
Doped carbon nanotubes as a model system of biased graphene
Albeit difficult to access experimentally, the density of states (DOS) is a
key parameter in solid state systems which governs several important phenomena
including transport, magnetism, thermal, and thermoelectric properties. We
study DOS in an ensemble of potassium intercalated single-wall carbon nanotubes
(SWCNT) and show using electron spin resonance spectroscopy that a sizeable
number of electron states are present, which gives rise to a Fermi-liquid
behavior in this material. A comparison between theoretical and the
experimental DOS indicates that it does not display significant correlation
effects, even though the pristine nanotube material shows a Luttinger-liquid
behavior. We argue that the carbon nanotube ensemble essentially maps out the
whole Brillouin zone of graphene thus it acts as a model system of biased
graphene
Fine-tuning the functional properties of carbon nanotubes via the interconversion of encapsulated molecules
Tweaking the properties of carbon nanotubes is a prerequisite for their
practical applications. Here we demonstrate fine-tuning the electronic
properties of single-wall carbon nanotubes via filling with ferrocene
molecules. The evolution of the bonding and charge transfer within the tube is
demonstrated via chemical reaction of the ferrocene filler ending up as
secondary inner tube. The charge transfer nature is interpreted well within
density functional theory. This work gives the first direct observation of a
fine-tuned continuous amphoteric doping of single-wall carbon nanotubes
Electron spin resonance signal of Luttinger liquids and single-wall carbon nanotubes
A comprehensive theory of electron spin resonance (ESR) for a Luttinger
liquid (LL) state of correlated metals is presented. The ESR measurables such
as the signal intensity and the line-width are calculated in the framework of
Luttinger liquid theory with broken spin rotational symmetry as a function of
magnetic field and temperature. We obtain a significant temperature dependent
homogeneous line-broadening which is related to the spin symmetry breaking and
the electron-electron interaction. The result crosses over smoothly to the ESR
of itinerant electrons in the non-interacting limit. These findings explain the
absence of the long-sought ESR signal of itinerant electrons in single-wall
carbon nanotubes when considering realistic experimental conditions.Comment: 5 pages, 1 figur
Ab-initio structural, elastic, and vibrational properties of carbon nanotubes
A study based on ab initio calculations is presented on the estructural,
elastic, and vibrational properties of single-wall carbon nanotubes with
different radii and chiralities. We use SIESTA, an implementation of
pseudopotential-density-functional theory which allows calculations on systems
with a large number of atoms per cell. Different quantities like bond
distances, Young moduli, Poisson ratio and the frequencies of different phonon
branches are monitored versus tube radius. The validity of expectations based
on graphite is explored down to small radii, where some deviations appear
related to the curvature effects. For the phonon spectra, the results are
compared with the predictions of the simple zone-folding approximation. Except
for the known defficiencies of this approximation in the low-frequency
vibrational regions, it offers quite accurate results, even for relatively
small radii.Comment: 13 pages, 7 figures, submitted to Phys. Rev. B (11 Nov. 98
Vibrational properties of single-wall nanotubes and monolayers of hexagonal BN
We report a detailed study of the vibrational properties of BN single-walled
nanotubes and of the BN monolayer. Our results have been obtained from a
well-established Tight-Binding model complemented with an electrostatic model
to account for the long-range interactions arising from the polar nature of the
material, and which are not included in the Tight-Binding model. Our study
provides a wealth of data for the BN monolayer and nanotubes, such as phonon
band structure, vibrational density of states, elastic constants, etc. For the
nanotubes we obtain the behavior of the optically active modes as a function of
the structural parameters, and we compare their frequencies with those derived
from a zone-folding treatment applied to the phonon frequencies of the BN
monolayer, finding general good agreement between the two.Comment: 14 pages with 10 postscript figures, to appear in PRB, January 15th
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