31 research outputs found
Nanoscale Processing by Adaptive Laser Pulses
We theoretically demonstrate that atomically-precise ``nanoscale processing"
can be reproducibly performed by adaptive laser pulses. We present the new
approach on the controlled welding of crossed carbon nanotubes, giving various
metastable junctions of interest. Adaptive laser pulses could be also used in
preparation of other hybrid nanostructures.Comment: 4 pages, 4 Postscript figure
Theoretical Study of One-dimensional Chains of Metal Atoms in Nanotubes
Using first-principles total-energy pseudopotential calculations, we have
studied the properties of chains of potassium and aluminum in nanotubes. For BN
tubes, there is little interaction between the metal chains and the tubes, and
the conductivity of these tubes is through carriers located at the inner part
of the tube. In contrast, for small radius carbon nanotubes, there are two
types of interactions: charge-transfer (dominant for alkali atoms) leading to
strong ionic cohesion, and hybridization (for multivalent metal atoms)
resulting in a smaller cohesion. For Al-atomic chains in carbon tubes, we show
that both effects contribute. New electronic properties related to these
confined atomic chains of metal are analyzed.Comment: 12 pages + 3 figure
Ab initio many-body calculations on infinite carbon and boron-nitrogen chains
In this paper we report first-principles calculations on the ground-state
electronic structure of two infinite one-dimensional systems: (a) a chain of
carbon atoms and (b) a chain of alternating boron and nitrogen atoms. Meanfield
results were obtained using the restricted Hartree-Fock approach, while the
many-body effects were taken into account by second-order M{\o}ller-Plesset
perturbation theory and the coupled-cluster approach. The calculations were
performed using 6-31 basis sets, including the d-type polarization
functions. Both at the Hartree-Fock (HF) and the correlated levels we find that
the infinite carbon chain exhibits bond alternation with alternating single and
triple bonds, while the boron-nitrogen chain exhibits equidistant bonds. In
addition, we also performed density-functional-theory-based local density
approximation (LDA) calculations on the infinite carbon chain using the same
basis set. Our LDA results, in contradiction to our HF and correlated results,
predict a very small bond alternation. Based upon our LDA results for the
carbon chain, which are in agreement with an earlier LDA calculation
calculation [ E.J. Bylaska, J.H. Weare, and R. Kawai, Phys. Rev. B 58, R7488
(1998).], we conclude that the LDA significantly underestimates Peierls
distortion. This emphasizes that the inclusion of many-particle effects is very
important for the correct description of Peierls distortion in one-dimensional
systems.Comment: 3 figures (included). To appear in Phys. Rev.
Caveolin-1 Gene Disruption Promotes Mammary Tumorigenesis and Dramatically Enhances Lung Metastasis in Vivo
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