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The Cohesive Energy and Vibration Characteristics of Parallel Single-Walled Carbon Nanotubes

Based on the van der Waals (vdW) interaction between carbon atoms, the interface cohesive energy between parallel single-walled carbon nanotubes was studied using continuous mechanics theory, and the influence of the diameter of carbon nanotubes and the distance between them on the cohesive energy w...

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Detalles Bibliográficos
Autores principales: Wang, Jun, Chen, Yinfeng, Yu, Peishi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8707357/
https://www.ncbi.nlm.nih.gov/pubmed/34946552
http://dx.doi.org/10.3390/molecules26247470
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author Wang, Jun
Chen, Yinfeng
Yu, Peishi
author_facet Wang, Jun
Chen, Yinfeng
Yu, Peishi
author_sort Wang, Jun
collection PubMed
description Based on the van der Waals (vdW) interaction between carbon atoms, the interface cohesive energy between parallel single-walled carbon nanotubes was studied using continuous mechanics theory, and the influence of the diameter of carbon nanotubes and the distance between them on the cohesive energy was analyzed. The results show that the size has little effect on the cohesive energy between carbon nanotubes when the length of carbon nanotubes is over 10 nm. At the same time, we analyzed the cohesive energy between parallel carbon nanotubes with the molecular dynamics simulation method. The results of the two methods were compared and found to be very consistent. Based on the vdW interaction between parallel carbon nanotubes, the vibration characteristics of the two parallel carbon nanotube system were analyzed based on the continuous mechanical Euler-beam model. The effects of the vdW force between carbon nanotubes, the diameter and length of carbon nanotubes on the vibration frequency of carbon nanotubes was studied. The obtained results are helpful in improving the understanding of the vibration characteristics of carbon nanotubes and provide an important theoretical basis for their application.
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spelling pubmed-87073572021-12-25 The Cohesive Energy and Vibration Characteristics of Parallel Single-Walled Carbon Nanotubes Wang, Jun Chen, Yinfeng Yu, Peishi Molecules Article Based on the van der Waals (vdW) interaction between carbon atoms, the interface cohesive energy between parallel single-walled carbon nanotubes was studied using continuous mechanics theory, and the influence of the diameter of carbon nanotubes and the distance between them on the cohesive energy was analyzed. The results show that the size has little effect on the cohesive energy between carbon nanotubes when the length of carbon nanotubes is over 10 nm. At the same time, we analyzed the cohesive energy between parallel carbon nanotubes with the molecular dynamics simulation method. The results of the two methods were compared and found to be very consistent. Based on the vdW interaction between parallel carbon nanotubes, the vibration characteristics of the two parallel carbon nanotube system were analyzed based on the continuous mechanical Euler-beam model. The effects of the vdW force between carbon nanotubes, the diameter and length of carbon nanotubes on the vibration frequency of carbon nanotubes was studied. The obtained results are helpful in improving the understanding of the vibration characteristics of carbon nanotubes and provide an important theoretical basis for their application. MDPI 2021-12-10 /pmc/articles/PMC8707357/ /pubmed/34946552 http://dx.doi.org/10.3390/molecules26247470 Text en © 2021 by the authors. https://creativecommons.org/licenses/by/4.0/Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Article
Wang, Jun
Chen, Yinfeng
Yu, Peishi
The Cohesive Energy and Vibration Characteristics of Parallel Single-Walled Carbon Nanotubes
title The Cohesive Energy and Vibration Characteristics of Parallel Single-Walled Carbon Nanotubes
title_full The Cohesive Energy and Vibration Characteristics of Parallel Single-Walled Carbon Nanotubes
title_fullStr The Cohesive Energy and Vibration Characteristics of Parallel Single-Walled Carbon Nanotubes
title_full_unstemmed The Cohesive Energy and Vibration Characteristics of Parallel Single-Walled Carbon Nanotubes
title_short The Cohesive Energy and Vibration Characteristics of Parallel Single-Walled Carbon Nanotubes
title_sort cohesive energy and vibration characteristics of parallel single-walled carbon nanotubes
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8707357/
https://www.ncbi.nlm.nih.gov/pubmed/34946552
http://dx.doi.org/10.3390/molecules26247470
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