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The influences of electric field intensity and driving force on the slip behaviour of water flow in a nanochannel

In the present work, non-equilibrium molecular dynamics (MD) simulations are used to investigate the flow of liquid water between two metallic solid atomistic smooth walls. The present work focuses on the combined effect of external electric field and driving force on the slip behaviour and structur...

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Detalles Bibliográficos
Autores principales: Liu, Qiwei, Wang, Dezheng, Yu, Miao, Cong, Biao, Yu, Xiaopeng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8457446/
https://www.ncbi.nlm.nih.gov/pubmed/34551001
http://dx.doi.org/10.1371/journal.pone.0257589
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author Liu, Qiwei
Wang, Dezheng
Yu, Miao
Cong, Biao
Yu, Xiaopeng
author_facet Liu, Qiwei
Wang, Dezheng
Yu, Miao
Cong, Biao
Yu, Xiaopeng
author_sort Liu, Qiwei
collection PubMed
description In the present work, non-equilibrium molecular dynamics (MD) simulations are used to investigate the flow of liquid water between two metallic solid atomistic smooth walls. The present work focuses on the combined effect of external electric field and driving force on the slip behaviour and structure of liquid water at the solid-water interface. The upper wall of the set model is positively charged, and the lower wall of the model is negatively charged. The simulation results show that as the driving force increases, the slip length also increases. At a given driving force, no matter how the electric field intensity changes, there is almost no change in the slip length, so the slip length is independent of the electric field strength. In addition, the results found that there is a linear relationship between the slip length and the normalised main peak of the static structure factor under different driving forces.
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spelling pubmed-84574462021-09-23 The influences of electric field intensity and driving force on the slip behaviour of water flow in a nanochannel Liu, Qiwei Wang, Dezheng Yu, Miao Cong, Biao Yu, Xiaopeng PLoS One Research Article In the present work, non-equilibrium molecular dynamics (MD) simulations are used to investigate the flow of liquid water between two metallic solid atomistic smooth walls. The present work focuses on the combined effect of external electric field and driving force on the slip behaviour and structure of liquid water at the solid-water interface. The upper wall of the set model is positively charged, and the lower wall of the model is negatively charged. The simulation results show that as the driving force increases, the slip length also increases. At a given driving force, no matter how the electric field intensity changes, there is almost no change in the slip length, so the slip length is independent of the electric field strength. In addition, the results found that there is a linear relationship between the slip length and the normalised main peak of the static structure factor under different driving forces. Public Library of Science 2021-09-22 /pmc/articles/PMC8457446/ /pubmed/34551001 http://dx.doi.org/10.1371/journal.pone.0257589 Text en © 2021 Liu et al https://creativecommons.org/licenses/by/4.0/This is an open access article distributed under the terms of the Creative Commons Attribution License (https://creativecommons.org/licenses/by/4.0/) , which permits unrestricted use, distribution, and reproduction in any medium, provided the original author and source are credited.
spellingShingle Research Article
Liu, Qiwei
Wang, Dezheng
Yu, Miao
Cong, Biao
Yu, Xiaopeng
The influences of electric field intensity and driving force on the slip behaviour of water flow in a nanochannel
title The influences of electric field intensity and driving force on the slip behaviour of water flow in a nanochannel
title_full The influences of electric field intensity and driving force on the slip behaviour of water flow in a nanochannel
title_fullStr The influences of electric field intensity and driving force on the slip behaviour of water flow in a nanochannel
title_full_unstemmed The influences of electric field intensity and driving force on the slip behaviour of water flow in a nanochannel
title_short The influences of electric field intensity and driving force on the slip behaviour of water flow in a nanochannel
title_sort influences of electric field intensity and driving force on the slip behaviour of water flow in a nanochannel
topic Research Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8457446/
https://www.ncbi.nlm.nih.gov/pubmed/34551001
http://dx.doi.org/10.1371/journal.pone.0257589
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