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Interwall interaction energies of double-walled nanotubes (DWNTs) with long inner and short outer walls are calculated as functions of coordinates describing relative rotation and displacement of the walls using van der Waals corrected…

Mesoscale and Nanoscale Physics · Physics 2015-06-15 Andrey M. Popov , Irina V. Lebedeva , Andrey A. Knizhnik , Yurii E. Lozovik , Boris V. Potapkin

Carbon Nanotubes have shown to be an attractive option in the race to find a replacement to silicon-based transistors, due to its high electrical conductivity, extraordinary mechanical strength, and thermal conductivity. However, challenges…

Using first principles calculations, we model the chemical vapor deposition (CVD) growth of carbon nanotubes (CNT) on nanoparticles of late transition (Ni, Pd, Pt) and coinage (Cu, Ag, Au) metals. The process is analyzed in terms of the…

Materials Science · Physics 2008-04-17 Oleg V. Yazyev , Alfredo Pasquarello

How chirality propagates across scales remains an open question in many biological and synthetic systems. An especially clear manifestation of this propagation is found in in vitro gliding assays of cytoskeletal filaments on surfaces,…

The continuous two-dimensional (2D) elastic model for single-walled carbon nanotubes (SWNTs) provided by Tu and Ou-Yang in [Phys. Rev. B \textbf{65}, 235411 (2003)] is reduced to a one-dimensional (1D) curvature elastic model strictly. This…

Mesoscale and Nanoscale Physics · Physics 2015-03-18 Xiaohua Zhou

The miniaturization of gears towards the nanoscale is a formidable task posing a variety of challenges to current fabrication technologies. In context, the understanding, via computer simulations, of the mechanisms mediating the transfer of…

Mesoscale and Nanoscale Physics · Physics 2020-09-25 Huang-Hsiang Lin , Jonathan Heinze , Alexander Croy , Rafael Gutierrez , Gianaurelio Cuniberti

We study the effect of the Rashba spin-orbit interaction in the quantum transport of carbon nanotubes with arbitrary chiralities. For certain spin directions, we find a strong spin-polarized electrical current that depends on the diameter…

Mesoscale and Nanoscale Physics · Physics 2016-04-28 Hernán Santos , A. Latgé , J. E. Alvarellos , Leonor Chico

The electrical properties of a carbon nanotube depend strongly on its lattice structure as defined by chiral and translational vectors. A toroidal shape for a nanotube allows various twisted structures to exist along the direction of the…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 K. Sasaki , Y. Kawazoe

Efforts aimed at large-scale integration of nanoelectronic devices that exploit the superior electronic and mechanical properties of single-walled carbon nanotubes (SWCNTs) remain limited by the difficulties associated with manipulation and…

We proposed a new way, adding intertube atoms, to enhance interfacial thermal conductance (ITC) between SiC-carbon nanotube (CNT) array structure. Non-equilibrium molecular dynamics method was used to study the ITC. The results show that…

Mesoscale and Nanoscale Physics · Physics 2016-06-10 Chengcheng Deng , Xiaoxiang Yu , Xiaoming Huang , Nuo Yang

The interactions between carbon nanotubes (CNTs) and metal adatoms as well as metal contacts are studied by means of ab initio electronic structure calculations. We show that the electronic properties of a semiconducting (8,4) CNT can be…

Mesoscale and Nanoscale Physics · Physics 2017-07-04 F. Fuchs , A. Zienert , C. Wagner , J. Schuster , S. E. Schulz

Large-scale fully interconnected ring carbon nanotube (CNT) networks were first prepared using thermo chemical vapor deposition in nano-channel network templates of porous anodic alumina. This conductive CNT network film consists of…

Materials Science · Physics 2007-05-23 Zhi-An Ren , Jun Akimitsu

A nanoscopic simulation for an acceleration sensor is aimed based on the piezoresistive effect of carbon nanotubes (CNTs). Therefore, a compact model is built from density functional theory (DFT), compared with results of molecular dynamics…

Mesoscale and Nanoscale Physics · Physics 2017-07-04 C. Wagner , S. Hartmann , B. Wunderle , J. Schuster , S. E. Schulz , T. Gessner

This work presents a model that successfully describes the tensile properties of macroscopic fibres of carbon nanotubes (CNTs). The core idea is to treat such a fibre as a network of CNT bundles, similar to the structure of high-performance…

Materials Science · Physics 2019-03-01 J. C. Fernández-Toribio , B. Alemán , A. Ridruejo , J. J. Vilatela

The rheological and electrical properties of suspensions of carbon nanotubes in an uncured epoxy resin were investigated by means of shear rheology and impedance spectroscopy. It was found that above an onset CNT weight fraction (0.1 wt %),…

Materials Science · Physics 2013-10-07 Aissa Allaoui , Nour-Eddine El Bounia

We clarify the relationships between the eight structural types of toroidal carbon nanotubes (TCNTs), which can be identified as the eight corners of a cube of structural transformation. The four families with Dnh symmetry can be related by…

Atomic and Molecular Clusters · Physics 2012-12-20 Chern Chuang , Yuan-Chia Fan , Bih-Yaw Jin

We present first-principles calculations of phase coherent electron transport in a carbon nanotube (CNT) with realistic contacts. We focus on the zero-bias response of open metallic CNT's considering two archetypal contact geometries (end…

Materials Science · Physics 2009-11-07 J. J. Palacios , A. J. Perez-Jimenez , E. Louis , E. SanFabian , J. A. Verges

Carbon nanotube networks are one of the candidate materials to function as malleable, transparent, conducting films, with the technologically promising application of being used as flexible electronic displays. Nanotubes disorderly…

Mesoscale and Nanoscale Physics · Physics 2013-02-22 Luiz F. C. Pereira , M. S. Ferreira

The promise of enhanced performance has motivated the study of one dimensional nanomaterials, especially aligned carbon nanotubes (A-CNTs), for the reinforcement of polymeric materials. While early work has shown that CNTs have remarkable…

Applied Physics · Physics 2017-12-19 Itai Y. Stein , Brian L. Wardle

Carbon nanotubes (CNT) have been recently proposed as stabilizers against grain growth that can happen even at low temperature inputs in nano-crystalline and ultrafine-grained materials obtained by severe plastic deformation. In this study,…

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