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We present a study on the quantum transport properties of chemically functionalized metallic double-walled carbon nanotubes (DWNTs) with lengths reaching the micrometer scale. First-principles calculations evidence that, for coaxial tubes…

Materials Science · Physics 2016-03-29 Alejandro Lopez-Bezanilla

The structure and elastic properties of (5,5) and (10,10) nanotubes, as well as barriers for relative rotation of the walls and their relative sliding along the axis in a double-walled (5,5)@(10,10) carbon nanotube, are calculated using the…

Mesoscale and Nanoscale Physics · Physics 2015-05-13 A. M. Popov , Yu. E. Lozovik , A. S. Sobennikov , A. A. Knizhnik

Carbon nanotubes (CNTs) are a promising material for high-performance electronics beyond silicon. But unlike silicon, the nature of the transport band gap in CNTs is not fully understood. The transport gap in CNTs is predicted to be…

We present quantum simulations of carbon nanotube field-effect transistors (CNT-FETs) based on top-gated architectures and compare to electrical characterization on devices with 15 nm channel lengths. A non-equilibrium Green's function…

Mesoscale and Nanoscale Physics · Physics 2021-10-27 Alfonso Sanchez-Soares , Thomas Kelly , Giorgos Fagas , James C. Greer , Edward Chen

An equivalent-multishell approach for the approximate calculation of the characteristics of electromagnetic waves propagating in almost circular (azimuthally symmetric), closely packed bundles of parallel, identical, and metallic carbon…

Materials Science · Physics 2009-11-13 M. V. Shuba , S. A. Maksimenko , A. Lakhtakia

The heat flux autocorrelation functions of carbon nanotubes (CNTs) with different radius and lengths is calculated using equilibrium molecular dynamics. The thermal conductance of CNTs is also calculated using the Green-Kubo relation from…

Materials Science · Physics 2009-11-10 Zhenhua Yao , Jian-Sheng Wang , Baowen Li , Gui-Rong Liu

We have explored the low-temperature linear and non-linear electrical conductance $G$ of metallic carbon nanotubes (CNTs), which were grown by the chemical-vapor deposition method. The high transparency of the contacts allows to study these…

Materials Science · Physics 2009-11-10 Bakir Babic , Christian Schonenberger

This investigation deals with the effect of growth temperature on the growth behavior of Fe filled multiwalled carbon nanotubes (MWCNTs). Carbon nanotube (CNT) synthesis was carried out in a thermal chemical vapor deposition (CVD) reactor…

Materials Science · Physics 2019-08-07 Joydip Sengupta , Chacko Jacob

Recently experiments showed that nodal structural defects are readily formed in the synthesis of single-walled carbon nanotubes (SWNTs) and consequently, SWNTs are likely to deviate from well-defined seamless tubular structures. Here, using…

Mesoscale and Nanoscale Physics · Physics 2014-10-02 Young I. Jhon , Woonjo Cho , Seok Lee , Young Min Jhon

The electronic properties of multi-wall carbon nanotubes (MWNTs) have attracted much attention because they could lead to nano-sized electronic devices. Using chemical vapor deposition (CVD), MWNTs are produced in large quantities at a low…

Materials Science · Physics 2007-05-23 Hisashi Kajiura , Anil Nandyala , Alexey Bezryadin

The electrical conductivity of the polyimide R-BAPB polymer filled with single-wall carbon nanotubes (CNT) with chirality (5,5) is modeled using a multi-scale approach. The modeling starts with molecular dynamics simulations of…

Materials Science · Physics 2021-06-30 S. V. Larin , S. V. Lyulin , P. A. Likhomanova , K. Yu. Khromov , A. A. Knizhnik , B. V. Potapkin

The mechanical properties of the so-called `super' carbon nanotubes (STs) are investigated using classical molecular dynamics simulations. The STs are built from single walled carbon nanotubes (SWCNTs) connected by Y-like junctions forming…

Materials Science · Physics 2009-11-13 Vitor R. Coluci , Nicola M. Pugno , Socrates O. Dantas , Douglas S. Galvao , Ado Jorio

The apex region of a capped (5,5) carbon nanotube (CNT) has been modelled with the DFT package ONETEP, using boundary conditions provided by a classical calculation with a conducting surface in place of the CNT. Results from the DFT…

Applied Physics · Physics 2019-01-17 C. J. Edgcombe , S. M. Masur , E. B. Linscott , J. A. J. Whaley-Baldwin , C. H. W. Barnes

Since their discovery in 1991, carbon nanotubes (CNTs) -- a novel one-dimensional carbon allotrope -- have attracted considerable interest worldwide because of their potential technological applications such as electric and optical devices.…

Astrophysics of Galaxies · Physics 2020-02-26 Qi Li , Aigen Li , B. W. Jiang , Tao Chen

Carbon nanotubes are of central importance for applications in nano-electronics thanks to their exceptional transport properties. They can be used as sensors, for example in biological applications, provided that they are functionalized to…

Mesoscale and Nanoscale Physics · Physics 2020-04-14 Ghassen Jemaï , Jouda Khabthani , Guy Trambly de Laissardière , Didier Mayou

Single walled carbon nanotubes (SWNT) have displayed a wealth of quantum transport phenomena thus far. Defect free, unperturbed SWNTs with wellbehaved or tunable metal contacts are important to probing the intrinsic electrical properties of…

Mesoscale and Nanoscale Physics · Physics 2015-06-25 Jien Cao , Qian Wang , Hongjie Dai

Recent studies of single-walled carbon nanotubes (CNTs) in aqueous media have showed that water can significantly affect the tube mechanical properties. CNTs under hydrostatic compression can preserve their elastic properties up to large…

Materials Science · Physics 2019-06-05 Gustavo Brunetto , Nádia F. Andrade , Douglas S. Galvão , Antônio G. Souza Filho

The electrolysis of CO$_2$ in molten carbonate has been introduced as an alternative mechanism to synthesize carbon nanomaterials inexpensively at high yield. Until recently, CO$_2$ was thought to be unreactive, making its removal a…

Materials Science · Physics 2022-01-21 Xinye Liu , Gad Licht , Xirui Wang , Stuart Licht

The present communication highlights that ac conductivity measurement of the multi-walled carbon nanotubes (MWNTs)-polymer composites is a very promising characterizing tool for qualifying any crude MWNT-sample synthesized by electric arc.…

Materials Science · Physics 2007-09-26 Soumen Karmakar , Harshada Nagar , J P Jog , S V Bhoraskar , A K Das

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