Cargando…
A Local-Exchange Model of Folding Chain Surface of Polymer Crystal Based on Worm-Like Chain Model within Single-Chain in Mean-Field Theory
The structure of amorphous layer of folding surface controls the properties of the polymer lamellar crystal, which consists of chains with a loop conformation. The surface tension depends on the length and the distance between two injection points of the loop which involving the reptation motion and...
Autores principales: | , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2020
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7693907/ https://www.ncbi.nlm.nih.gov/pubmed/33143387 http://dx.doi.org/10.3390/polym12112555 |
_version_ | 1783614854148390912 |
---|---|
author | Xiao, Hongyi Zhang, Xinghua Yan, Dadong |
author_facet | Xiao, Hongyi Zhang, Xinghua Yan, Dadong |
author_sort | Xiao, Hongyi |
collection | PubMed |
description | The structure of amorphous layer of folding surface controls the properties of the polymer lamellar crystal, which consists of chains with a loop conformation. The surface tension depends on the length and the distance between two injection points of the loop which involving the reptation motion and lateral exchange motion of the stems. In the present work, a local-exchange motion model based on the worm-like chain model is developed to investigate the effects of lateral motion of stems on the release the surface tension. The optimal distance between two injection points is determined by the balance of chain bending energy and conformational entropy. The numerical results provide evidences to the adjacent re-entry model for various loop lengths. A possible explanation involving density of injection points is proposed to interpret the mechanism. |
format | Online Article Text |
id | pubmed-7693907 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2020 |
publisher | MDPI |
record_format | MEDLINE/PubMed |
spelling | pubmed-76939072020-11-28 A Local-Exchange Model of Folding Chain Surface of Polymer Crystal Based on Worm-Like Chain Model within Single-Chain in Mean-Field Theory Xiao, Hongyi Zhang, Xinghua Yan, Dadong Polymers (Basel) Article The structure of amorphous layer of folding surface controls the properties of the polymer lamellar crystal, which consists of chains with a loop conformation. The surface tension depends on the length and the distance between two injection points of the loop which involving the reptation motion and lateral exchange motion of the stems. In the present work, a local-exchange motion model based on the worm-like chain model is developed to investigate the effects of lateral motion of stems on the release the surface tension. The optimal distance between two injection points is determined by the balance of chain bending energy and conformational entropy. The numerical results provide evidences to the adjacent re-entry model for various loop lengths. A possible explanation involving density of injection points is proposed to interpret the mechanism. MDPI 2020-10-30 /pmc/articles/PMC7693907/ /pubmed/33143387 http://dx.doi.org/10.3390/polym12112555 Text en © 2020 by the authors. 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 (http://creativecommons.org/licenses/by/4.0/). |
spellingShingle | Article Xiao, Hongyi Zhang, Xinghua Yan, Dadong A Local-Exchange Model of Folding Chain Surface of Polymer Crystal Based on Worm-Like Chain Model within Single-Chain in Mean-Field Theory |
title | A Local-Exchange Model of Folding Chain Surface of Polymer Crystal Based on Worm-Like Chain Model within Single-Chain in Mean-Field Theory |
title_full | A Local-Exchange Model of Folding Chain Surface of Polymer Crystal Based on Worm-Like Chain Model within Single-Chain in Mean-Field Theory |
title_fullStr | A Local-Exchange Model of Folding Chain Surface of Polymer Crystal Based on Worm-Like Chain Model within Single-Chain in Mean-Field Theory |
title_full_unstemmed | A Local-Exchange Model of Folding Chain Surface of Polymer Crystal Based on Worm-Like Chain Model within Single-Chain in Mean-Field Theory |
title_short | A Local-Exchange Model of Folding Chain Surface of Polymer Crystal Based on Worm-Like Chain Model within Single-Chain in Mean-Field Theory |
title_sort | local-exchange model of folding chain surface of polymer crystal based on worm-like chain model within single-chain in mean-field theory |
topic | Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7693907/ https://www.ncbi.nlm.nih.gov/pubmed/33143387 http://dx.doi.org/10.3390/polym12112555 |
work_keys_str_mv | AT xiaohongyi alocalexchangemodeloffoldingchainsurfaceofpolymercrystalbasedonwormlikechainmodelwithinsinglechaininmeanfieldtheory AT zhangxinghua alocalexchangemodeloffoldingchainsurfaceofpolymercrystalbasedonwormlikechainmodelwithinsinglechaininmeanfieldtheory AT yandadong alocalexchangemodeloffoldingchainsurfaceofpolymercrystalbasedonwormlikechainmodelwithinsinglechaininmeanfieldtheory AT xiaohongyi localexchangemodeloffoldingchainsurfaceofpolymercrystalbasedonwormlikechainmodelwithinsinglechaininmeanfieldtheory AT zhangxinghua localexchangemodeloffoldingchainsurfaceofpolymercrystalbasedonwormlikechainmodelwithinsinglechaininmeanfieldtheory AT yandadong localexchangemodeloffoldingchainsurfaceofpolymercrystalbasedonwormlikechainmodelwithinsinglechaininmeanfieldtheory |