Effect of disubstitute and conformational energy on unperturbed dimension of PDMS chain(侧基和构象能对PDMS分子链无扰尺寸的影响)
一种基于旋转异构态模型基础上的改进构象统计方法研究聚二甲基硅氧烷链(PDMS)的无扰尺寸.研究结果发现PDMS侧基结构对其短链的均方回转半径特征比影响较大,而长链时构型参数〈S2〉/M值仍趋向于7.76 ×10-3 nm • (g • mol) -1,与实验结果一致.对PDMS链特征比与一级相互作用能的关系作了数值计算,通过对各种模型计算结果的分析,发现如果取旋转异构态模型进行计算,考虑侧基的结构是十分必要的....
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Format: | Article |
Language: | zho |
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Zhejiang University Press
2009-09-01
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Series: | Zhejiang Daxue xuebao. Lixue ban |
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Online Access: | https://doi.org/10.3785/j.issn.1008-9497.2009.05.010 |
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author | MAHai-zhu(马海珠) |
author_facet | MAHai-zhu(马海珠) |
author_sort | MAHai-zhu(马海珠) |
collection | DOAJ |
description | 一种基于旋转异构态模型基础上的改进构象统计方法研究聚二甲基硅氧烷链(PDMS)的无扰尺寸.研究结果发现PDMS侧基结构对其短链的均方回转半径特征比影响较大,而长链时构型参数〈S2〉/M值仍趋向于7.76 ×10-3 nm • (g • mol) -1,与实验结果一致.对PDMS链特征比与一级相互作用能的关系作了数值计算,通过对各种模型计算结果的分析,发现如果取旋转异构态模型进行计算,考虑侧基的结构是十分必要的. |
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institution | Directory Open Access Journal |
issn | 1008-9497 |
language | zho |
last_indexed | 2024-04-24T16:58:28Z |
publishDate | 2009-09-01 |
publisher | Zhejiang University Press |
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series | Zhejiang Daxue xuebao. Lixue ban |
spelling | doaj.art-0a0f15e55eb446db86efff171b9793752024-03-29T01:58:27ZzhoZhejiang University PressZhejiang Daxue xuebao. Lixue ban1008-94972009-09-0136553053310.3785/j.issn.1008-9497.2009.05.010Effect of disubstitute and conformational energy on unperturbed dimension of PDMS chain(侧基和构象能对PDMS分子链无扰尺寸的影响)MAHai-zhu(马海珠)0College of Information and Electronic Engineering, Zhejiang Gongs hang University, Hangzhou 310018, China(浙江工商大学信息与电子工程学院,浙江 杭州 310018)一种基于旋转异构态模型基础上的改进构象统计方法研究聚二甲基硅氧烷链(PDMS)的无扰尺寸.研究结果发现PDMS侧基结构对其短链的均方回转半径特征比影响较大,而长链时构型参数〈S2〉/M值仍趋向于7.76 ×10-3 nm • (g • mol) -1,与实验结果一致.对PDMS链特征比与一级相互作用能的关系作了数值计算,通过对各种模型计算结果的分析,发现如果取旋转异构态模型进行计算,考虑侧基的结构是十分必要的.https://doi.org/10.3785/j.issn.1008-9497.2009.05.010旋转异构态(ris)侧基结构构象能均方回转半径聚二甲基硅氧烷 |
spellingShingle | MAHai-zhu(马海珠) Effect of disubstitute and conformational energy on unperturbed dimension of PDMS chain(侧基和构象能对PDMS分子链无扰尺寸的影响) Zhejiang Daxue xuebao. Lixue ban 旋转异构态(ris) 侧基结构 构象能 均方回转半径 聚二甲基硅氧烷 |
title | Effect of disubstitute and conformational energy on unperturbed dimension of PDMS chain(侧基和构象能对PDMS分子链无扰尺寸的影响) |
title_full | Effect of disubstitute and conformational energy on unperturbed dimension of PDMS chain(侧基和构象能对PDMS分子链无扰尺寸的影响) |
title_fullStr | Effect of disubstitute and conformational energy on unperturbed dimension of PDMS chain(侧基和构象能对PDMS分子链无扰尺寸的影响) |
title_full_unstemmed | Effect of disubstitute and conformational energy on unperturbed dimension of PDMS chain(侧基和构象能对PDMS分子链无扰尺寸的影响) |
title_short | Effect of disubstitute and conformational energy on unperturbed dimension of PDMS chain(侧基和构象能对PDMS分子链无扰尺寸的影响) |
title_sort | effect of disubstitute and conformational energy on unperturbed dimension of pdms chain 侧基和构象能对pdms分子链无扰尺寸的影响 |
topic | 旋转异构态(ris) 侧基结构 构象能 均方回转半径 聚二甲基硅氧烷 |
url | https://doi.org/10.3785/j.issn.1008-9497.2009.05.010 |
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