Phonons and Thermal Transport in Si/SiO<sub>2</sub> Multishell Nanotubes: Atomistic Study

Thermal transport in the Si/SiO<sub>2</sub> multishell nanotubes is investigated theoretically. The phonon energy spectra are obtained using the atomistic lattice dynamics approach. Thermal conductivity is calculated using the Boltzmann transport equation within the relaxation time appro...

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Main Authors: Calina Isacova, Alexandr Cocemasov, Denis L. Nika, Vladimir M. Fomin
Format: Article
Language:English
Published: MDPI AG 2021-04-01
Series:Applied Sciences
Subjects:
Online Access:https://www.mdpi.com/2076-3417/11/8/3419
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author Calina Isacova
Alexandr Cocemasov
Denis L. Nika
Vladimir M. Fomin
author_facet Calina Isacova
Alexandr Cocemasov
Denis L. Nika
Vladimir M. Fomin
author_sort Calina Isacova
collection DOAJ
description Thermal transport in the Si/SiO<sub>2</sub> multishell nanotubes is investigated theoretically. The phonon energy spectra are obtained using the atomistic lattice dynamics approach. Thermal conductivity is calculated using the Boltzmann transport equation within the relaxation time approximation. Redistribution of the vibrational spectra in multishell nanotubes leads to a decrease of the phonon group velocity and the thermal conductivity as compared to homogeneous Si nanowires. Phonon scattering on the Si/SiO<sub>2</sub> interfaces is another key factor of strong reduction of the thermal conductivity in these structures (down to 0.2 Wm<sup>−1</sup>K<sup>−1</sup> at room temperature). We demonstrate that phonon thermal transport in Si/SiO<sub>2</sub> nanotubes can be efficiently suppressed by a proper choice of nanotube geometrical parameters: lateral cross section, thickness and number of shells. We argue that such nanotubes have prospective applications in modern electronics, in cases when low heat conduction is required.
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spelling doaj.art-92375e4269f5401f89e2796f6668764b2023-11-21T15:03:09ZengMDPI AGApplied Sciences2076-34172021-04-01118341910.3390/app11083419Phonons and Thermal Transport in Si/SiO<sub>2</sub> Multishell Nanotubes: Atomistic StudyCalina Isacova0Alexandr Cocemasov1Denis L. Nika2Vladimir M. Fomin3E. Pokatilov Laboratory of Physics and Engineering of Nanomaterials, Department of Physics and Engineering, Moldova State University, MD-2009 Chisinau, MoldovaE. Pokatilov Laboratory of Physics and Engineering of Nanomaterials, Department of Physics and Engineering, Moldova State University, MD-2009 Chisinau, MoldovaE. Pokatilov Laboratory of Physics and Engineering of Nanomaterials, Department of Physics and Engineering, Moldova State University, MD-2009 Chisinau, MoldovaE. Pokatilov Laboratory of Physics and Engineering of Nanomaterials, Department of Physics and Engineering, Moldova State University, MD-2009 Chisinau, MoldovaThermal transport in the Si/SiO<sub>2</sub> multishell nanotubes is investigated theoretically. The phonon energy spectra are obtained using the atomistic lattice dynamics approach. Thermal conductivity is calculated using the Boltzmann transport equation within the relaxation time approximation. Redistribution of the vibrational spectra in multishell nanotubes leads to a decrease of the phonon group velocity and the thermal conductivity as compared to homogeneous Si nanowires. Phonon scattering on the Si/SiO<sub>2</sub> interfaces is another key factor of strong reduction of the thermal conductivity in these structures (down to 0.2 Wm<sup>−1</sup>K<sup>−1</sup> at room temperature). We demonstrate that phonon thermal transport in Si/SiO<sub>2</sub> nanotubes can be efficiently suppressed by a proper choice of nanotube geometrical parameters: lateral cross section, thickness and number of shells. We argue that such nanotubes have prospective applications in modern electronics, in cases when low heat conduction is required.https://www.mdpi.com/2076-3417/11/8/3419multishell nanotubesphononsthermal transportlattice-dynamics approach
spellingShingle Calina Isacova
Alexandr Cocemasov
Denis L. Nika
Vladimir M. Fomin
Phonons and Thermal Transport in Si/SiO<sub>2</sub> Multishell Nanotubes: Atomistic Study
Applied Sciences
multishell nanotubes
phonons
thermal transport
lattice-dynamics approach
title Phonons and Thermal Transport in Si/SiO<sub>2</sub> Multishell Nanotubes: Atomistic Study
title_full Phonons and Thermal Transport in Si/SiO<sub>2</sub> Multishell Nanotubes: Atomistic Study
title_fullStr Phonons and Thermal Transport in Si/SiO<sub>2</sub> Multishell Nanotubes: Atomistic Study
title_full_unstemmed Phonons and Thermal Transport in Si/SiO<sub>2</sub> Multishell Nanotubes: Atomistic Study
title_short Phonons and Thermal Transport in Si/SiO<sub>2</sub> Multishell Nanotubes: Atomistic Study
title_sort phonons and thermal transport in si sio sub 2 sub multishell nanotubes atomistic study
topic multishell nanotubes
phonons
thermal transport
lattice-dynamics approach
url https://www.mdpi.com/2076-3417/11/8/3419
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AT alexandrcocemasov phononsandthermaltransportinsisiosub2submultishellnanotubesatomisticstudy
AT denislnika phononsandthermaltransportinsisiosub2submultishellnanotubesatomisticstudy
AT vladimirmfomin phononsandthermaltransportinsisiosub2submultishellnanotubesatomisticstudy