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We demonstrate that one-dimensional moir\'e patterns, analogous to those found in twisted bilayer graphene, can arise in collapsed chiral carbon nanotubes. Resorting to a combination of approaches, namely, molecular dynamics to obtain the…

Carbon nanotubes are one-dimensional and very narrow. These obvious facts imply that under doping with boron and nitrogen, microscopic doping inhomogeneity is much more important than for bulk semiconductors. We consider the possibility of…

Materials Science · Physics 2009-11-07 Paul E. Lammert , Vincent H. Crespi , Angel Rubio

We use an atom-atom potential between carbon atoms to obtain an interaction potential between nanotubes (assumed rigid), thereby calculating the cohesive energy of a bunch of nanotubes in hexagonal two dimensional packing. The model…

Materials Science · Physics 2007-05-23 V. K. Jindal , Shuchi Gupta , K. Dharamvir

We study one dimensional (1D) carbon ribbons with the armchair edges and the zigzag carbon nanotubes and their counterparts with finite length (0D) in the framework of the H\"{u}ckel model. We prove that a 1D carbon ribbon is metallic if…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 A. V. Nikolaev , A. V. Bibikov , A. V. Avdeenkov , I. V. Bodrenko , E. V. Tkalya

Theoretical progress in graphene physics has largely relied on the application of a simple nearest-neighbor tight-binding model capable of predicting many of the electronic properties of this material. However, important features that…

Mesoscale and Nanoscale Physics · Physics 2019-04-03 Z. M. Abd El-Fattah , M. A. Kher-Elden , I. Piquero-Zulaica , F. J. Garcia de Abajo , J. E. Ortega

The localization length and density of states of carbon nanotubes are evaluated within the tight-binding approximation. By comparison with the corresponding results for the square lattice tubes, it is found that the hexagonal structure…

Mesoscale and Nanoscale Physics · Physics 2015-06-24 W Q Ran , J Chang , H T Lu , Y H Su , H G Luo , T Xiang

In a recent paper Liang {\it et al.} [Nature {\bf 411}, 665 (2001)] showed experimentally, that metallic nanotubes, strongly coupled to external electrodes, may act as coherent molecular waveguides for electronic transport. The experimental…

Mesoscale and Nanoscale Physics · Physics 2009-11-07 S. Krompiewski , J. Martinek , J. Barnas

A novel two-dimensional carbon allotrope called PCF-graphene has been theoretically proposed. The development of its nanostructured morphology has arrangement a non-aromatic molecule cyclooctatetraene as a precursor (poly-cyclooctatetraene…

Computational Physics · Physics 2023-10-04 Reza Kalami , Seyed Ahmad Ketabi , José M. De Sousa

Based on first-principles calculations we predict a peculiar growth process, where carbon adatoms adsorbed to graphene readily diffuse above room temperature and nucleate segments of linear carbon chains attached to graphene. These chains…

Materials Science · Physics 2011-05-03 C. Ataca , S. Ciraci

We consider the effect of various defects and boundary structures on the low energy electronic properties in conducting zigzag and armchair carbon nanotubes. The tight binding model of the conduction bands is mapped exactly onto simple…

Mesoscale and Nanoscale Physics · Physics 2010-10-20 Sebastian A. Reyes , Alexander Struck , Sebastian Eggert

Graphene and carbon nanotubes represent the ultimate size limit of one and two-dimensional nanoelectromechanical resonators. Because of their reduced dimensionality, graphene and carbon nanotubes display unusual mechanical behavior; in…

Mesoscale and Nanoscale Physics · Physics 2011-10-07 J. Moser , A. Eichler , B. Lassagne , J. Chaste , Y. Tarakanov , J. Kinaret , I. Wilson-Rae , A. Bachtold

We numerically investigate the electronic transport properties of graphene nanoribbons and carbon nanotubes with inter-valley coupling, e.g., in \sqrt{3}N \times \sqrt{3}N and 3N \times 3N superlattices. By taking the \sqrt{3} \times…

Mesoscale and Nanoscale Physics · Physics 2017-01-04 Fuming Xu , Zhizhou Yu , Yafei Ren , Bin Wang , Yadong Wei , Zhenhua Qiao

The electron transport through the nanotube junctions which connect the different metallic nanotubes by a pair of a pentagonal defect and a heptagonal defect is investigated by Landauer's formula and the effective mass approximation. From…

Mesoscale and Nanoscale Physics · Physics 2016-08-31 Ryo Tamura , Masaru Tsukada

We study eigenvalue distribution of the adjacency matrix $A^{(N,p,q)}$ of weighted random uniform $q$-hypergraphs $\Gamma= \Gamma_{N,p,q}$. We assume that the graphs have $N$ vertices and the average number of hyperedges attached to one…

Combinatorics · Mathematics 2025-08-20 Valentin Vengerovsky

The equation of state of H2 adsorbed in the interstitial channels of a carbon nanotube bundle has been calculated using the diffusion Monte Carlo method. The possibility of a lattice dilation, induced by H2 adsorption, has been analyzed by…

Condensed Matter · Physics 2009-11-10 M. C. Gordillo , J. Boronat , J. Casulleras

We investigated the atomic structures, Raman spectroscopic and electrical transport properties of individual graphene nanoribbons (GNRs, widths ~10-30 nm) derived from sonochemical unzipping of multi-walled carbon nanotubes (MWNTs).…

Materials Science · Physics 2011-06-21 Liming Xie , Hailiang Wang , Chuanhong Jin , Xinran Wang , Liying Jiao , Kazu Suenaga , Hongjie Dai

We study by density functional and large scale tight-binding transport calculations the electronic structure, magnetism and transport properties of the recently proposed graphene ribbons with edges rolled to form nanotubes. Edges with…

Mesoscale and Nanoscale Physics · Physics 2015-06-11 M. A. Akhukov , Shengjun Yuan , A. Fasolino , M. I. Katsnelson

Graphene - a monolayer of carbon atoms densely packed into a hexagonal lattice - has one of the strongest possible atomic bonds and can be viewed as a robust atomic-scale scaffold, to which other chemical species can be attached without…

Carbon atoms can form structures in one, two, and three dimensions due to its unique chemical versatility. In terms of thermal conductivity, carbon polymorphs cover a wide range from very low values with amorphous carbon to very high values…

Materials Science · Physics 2013-10-22 Luiz Felipe C. Pereira , Ivana Savić , Davide Donadio

Scanning tunneling images of carbon nanotubes frequently show electron distributions which break the local sixfold symmetry of the graphene sheet. We present a theory of these images which relates these anisotropies to the off diagonal…

Mesoscale and Nanoscale Physics · Physics 2009-10-31 C. L. Kane , E. J. Mele