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Here, we report the performance of vacancy affected supercell of a hybrid Graphene-Boron Nitride embedded armchair nanoribbon (a-GNR-BN) based n-MOSFET at its ballistic transport limit using Non Equilibrium Green's Function (NEGF)…

Mesoscale and Nanoscale Physics · Physics 2015-12-07 Anuja Chanana , Amretashis Sengupta , Santanu Mahaptra

We found a giant Seebeck effect in semiconducting single-wall carbon nanotube (SWCNT) films, which exhibited a performance comparable to that of commercial Bi2Te3 alloys. Carrier doping of semiconducting SWCNT films further improved the…

Mesoscale and Nanoscale Physics · Physics 2014-01-30 Yusuke Nakai , Kazuya Honda , Kazuhiro Yanagi , Hiromichi Kataura , Teppei Kato , Takahiro Yamamoto , Yutaka Maniwa

Angular perturbations modify the band structure of armchair (and other metallic) carbon nanotubes by breaking the tube symmetry and may induce a metal-semiconductor transition when certain selection rules are satisfied. The symmetry…

Mesoscale and Nanoscale Physics · Physics 2021-07-02 Yan Li , Slava V. Rotkin , Umberto Ravaioli

We perform a detailed analysis of the band structure, phonon dispersion, and electron-phonon coupling of three types of small-radius carbon nanotubes (CNTs): (5,0), (6,0), and (5,5) with diameters 3.9, 4.7, and 6.8 \AA respectively. The…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 Ryan Barnett , Eugene Demler , Efthimios Kaxiras

This work discusses optical singularities and electrical conductivity behavior in a thin electrooptical cell filled with composites including multi-walled carbon nanotubes (MWCNTs) and nematic liquid crystal (LC). The MWCNTs with high…

Mesoscale and Nanoscale Physics · Physics 2012-01-10 V. V. Ponevchinsky , A. I. Goncharuk , V. I. Vasil'ev , N. I. Lebovka , M. S. Soskin

The results from mass spectrometry of clusters sputtered from Cs+ irradiated single-walled carbon nano-tubes (SWCNTs) as a function of energy and dose identify the nature of the resulting damage in the form of multiple vacancy generation.…

Atomic and Molecular Clusters · Physics 2016-10-05 Sumera Javeed , Sumaira Zeeshan , Shoaib Ahmad

A freestanding film of vertically aligned single-walled carbon nanotubes (VA-SWNTs) synthesized by the alcohol catalytic chemical vapor deposition (ACCVD) method was observed directly by transmission electron microscopy (TEM). These…

A 1 $\mu$m long, field emitting, (5,5) single-walled, carbon nanotube (SWCNT) closed with a fullerene cap, and a similar open nanotube with hydrogen-atom termination, have been simulated using the MNDO (Modified Neglect of Diatomic Overlap)…

Semiconducting single-walled carbon nanotubes (SWCNTs) are a promising thermoelectric material with high power factors after chemical p- or n-doping. Understanding the impact of dopant counterions on charge transport and thermoelectric…

High performance p- and n-type single-walled carbon nanotube (SWNT) field-effect transistors (FETs) are obtained by using high and low work function metals, Pd and Al as source/drain (S/D) electrodes respectively. Ohmic contacts made to…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Ali Javey , Qian Wang , Woong Kim , Hongjie Dai

We demonstrate the physical principles for the construction of a nanometer sized magnetoresistance device based on the Aharonov-Bohm effect. The proposed device is made of a short single-walled carbon nanotube (SWCNT) placed on a substrate…

Materials Science · Physics 2009-11-10 Oded Hod , Eran Rabani , Roi Baer

The robustness of topological materials against disorder and defects is presumed but has not been demonstrated explicitly in realistic systems. In this work, we use state-of-the-art density functional theory and recursive nonequilibrium…

Mesoscale and Nanoscale Physics · Physics 2021-01-27 Armando Pezo , Bruno Focassio , Gabriel R. Schleder , Marcio Costa , Caio Lewenkopf , Adalberto Fazzio

The Order (N) Tight Binding Molecular Dynamics (TBMD) algorithms applied to simulate the tensile elongations of short (2-2.5 nm) armchair and zigzag Single Walled Carbon Nanotubes (SWCNTs) without bond breakings or defect formation.…

Materials Science · Physics 2013-01-15 Gulay Dereli , Banu Sungu Misirlioglu , Onder Eyecioglu , Necati Vardar

In this paper, we present a new theoretical model for the dielectrophoresis (DEP) process of the single-walled carbon nanotubes (SWCNT). We obtain a different frequency interval for the alignment of wide energy gap semiconductor SWCNTs…

We show that quantum confinement in the valence and conduction bands of semiconducting single-walled carbon nanotubes can be engineered by means of artificial defects. This ability holds potential for designing future nanotube-based quantum…

Mesoscale and Nanoscale Physics · Physics 2018-03-21 Gilles Buchs , Dario Bercioux , Leonhard Mayrhofer , Oliver Gröning

We have theoretically investigated the thermoelectric properties of impurity-doped one-dimensional semiconductors, focusing on nitrogen-substituted (N-substituted) carbon nanotubes (CNTs), using the Kubo formula combined with a…

Mesoscale and Nanoscale Physics · Physics 2018-02-14 Takahiro Yamamoto , Hidetoshi Fukuyama

We investigate the local atomic and electronic structure, thermodynamic stability, and defect chemistry of $A_{6}B_{2}$O$_{17}$ ($A$ = Zr/Hf, $B$ = Nb/Ta) oxides using first-principles density functional theory (DFT) calculations. We…

Materials Science · Physics 2025-09-24 Jacob T. Sivak , R. Jackson Spurling , Jon-Paul Maria , Susan B. Sinnott

A complete explanation of the synthesis of metal-catalyst nanoparticles, and the subsequent nucleation and growth of bundles of C-SWNTs is introduced using a novel model. It is shown that the synthesis process leads to the formation of a…

Materials Science · Physics 2007-05-23 F. Larouche , J. Duquette , L. Cortelezzi , N. Nigam , B. Stansfield

The emergence of exotic charge density wave (CDW) alongside ferrimagnetism materials opens exciting new possibilities for quantum switching, particularly in field-tuning CDW electronics. However, these two phenomena often compete and rely…

We report on single-wall carbon nanotube (SWCNT) specific $^{13}$C isotope enrichment. The high temperature annealing of isotope enriched fullerenes encapsulated in SWCNTs yields double-wall carbon nanotubes (DWCNTs) with a high isotope…

Materials Science · Physics 2007-05-23 F. Simon , Ch. Kramberger , R. Pfeiffer , H. Kuzmany , V. Zolyomi , J. Kurti , P. M. Singer , H. Alloul
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