Molecular Dynamics Simulation and Theoretical Model of Elasticity in Slide-Ring Gels

Yasuda Yusuke; Masumoto Takeyoshi; Mayumi Koichi; Toda Masatoshi; Yokoyama Hideaki; Morita Hiroshi; Ito Kohzo

首页> 外文期刊>ACS Macro Letters >Molecular Dynamics Simulation and Theoretical Model of Elasticity in Slide-Ring Gels

【24h】

Molecular Dynamics Simulation and Theoretical Model of Elasticity in Slide-Ring Gels

机译：滑环凝胶中弹性的分子动力学模拟与结构模型

获取原文

获取原文并翻译 | 示例

掌桥外文数据库（机构版） >>

开具论文收录证明 >>

文献代查 >>

页面导航

摘要
著录项
相似文献
相关主题

摘要

In this study, molecular dynamics (MD) simulations were carried out on the uniaxial deformation of slide-ring (SR) networks with slidable cross-links to understand the relationship between the sliding of the cross-linking points and the Young's moduli of SR gels, which are lower than those of covalently cross-linked gels with the same cross-linking densities. The slidability of the cross-links in SR gels was characterized by the rate of change of the segment number between the cross-links, Nslide, estimated by the MD simulation. We have successfully constructed a molecular model for the elasticity of SR gels and proposed a simple equation for the Young's moduli of SR gels as a function of Nslide. The theoretical model was compared with the MD simulation results and experimental data.

机译：在该研究中，分子动力学（MD）模拟是对滑环（SR）网络的单轴变形，其具有可滑动的交叉，以了解交联点滑动与SR凝胶的杨氏模胶之间的关系，低于具有相同交联密度的共价交联凝胶的那些。 Sr凝胶中的交联的滑动性的特征在于通过MD模拟估计的交联链路，NSLIDE之间的区段数的变化率。我们已经成功构建了SR凝胶弹性的分子模型，并提出了杨氏调节的简单方程作为NSLIDE的函数。将理论模型与MD仿真结果和实验数据进行比较。

著录项

来源
《ACS Macro Letters》 |2020年第9期|共6页
作者
Yasuda Yusuke; Masumoto Takeyoshi; Mayumi Koichi; Toda Masatoshi; Yokoyama Hideaki; Morita Hiroshi; Ito Kohzo;
展开▼
作者单位

Univ Tokyo Mat Innovat Res Ctr MIRC Grad Sch Frontier Sci Kashiwa Chiba 2778561 Japan;

Univ Tokyo Dept Appl Chem Grad Sch Engn Bunkyo Ku Tokyo 1138654 Japan;

Univ Tokyo Mat Innovat Res Ctr MIRC Grad Sch Frontier Sci Kashiwa Chiba 2778561 Japan;

Natl Inst Adv Ind Sci &

Technol Tsukuba Ibaraki 3058568 Japan;

Univ Tokyo Mat Innovat Res Ctr MIRC Grad Sch Frontier Sci Kashiwa Chiba 2778561 Japan;

Natl Inst Adv Ind Sci &

Technol Tsukuba Ibaraki 3058568 Japan;

Univ Tokyo Mat Innovat Res Ctr MIRC Grad Sch Frontier Sci Kashiwa Chiba 2778561 Japan;

展开▼
收录信息
原文格式 PDF
正文语种 eng
中图分类有机化学;
关键词

相似文献

外文文献
中文文献
专利

1. 硅酸钙熔体局域结构的经典分子动力学模拟与结构热力学模型的比较 [J] . 吴永全, 戴辰, 蒋国昌中国有色金属学报（英文版） . 2014,第005期
2. 硅酸钙熔体局域结构的经典分子动力学模拟与结构热力学模型的比较 [J] . 吴永全, 戴辰, 蒋国昌中国有色金属学报：英文版 . 2014,第005期
3. Molecular Dynamics Simulation and Theoretical Model of Elasticity in Slide-Ring Gels [J] . Yasuda Yusuke, Masumoto Takeyoshi, Mayumi Koichi, ACS Macro Letters . 2020,第9期

机译：滑环凝胶中弹性的分子动力学模拟与结构模型
4. A Large Strain Isotropic Elasticity Model Based on Molecular Dynamics Simulations of a Metallic Glass [J] . David L. Henann, Lallit Anand Journal of Elasticity . 2011,第1a2期

机译：基于分子动力学模拟的金属玻璃大应变各向同性弹性模型
5. A Large Strain Isotropic Elasticity Model Based on Molecular Dynamics Simulations of a Metallic Glass [J] . David L. Henann, Lallit Anand Journal of Elasticity . 2011,第1a2期

机译：基于分子动力学模拟的金属玻璃大应变各向同性弹性模型
6. Brownian Dynamics Simulation of Diffusion in Slide-Ring Gel [C] . Masako Takasu, Takahiro Mimura International Workshop on Complex Systems . 2008

机译：拉环凝胶中扩散的布朗动力学模拟
7. Theoretical Modeling and Molecular Dynamics Simulation of Atomic Scale Wear: A Combined Study [D] . Shao, Yuchong. 2016

机译：原子尺度磨损的理论建模与分子动力学模拟：组合研究
8. Designing the Slide-Ring Polymer Network with both Good Mechanical and Damping Properties via Molecular Dynamics Simulation [O] . Zhiyu Zhang, Guanyi Hou, Jianxiang Shen, 2018

机译：通过分子动力学模拟设计具有良好机械性能和阻尼性能的滑环聚合物网络
9. Designing the Slide-Ring Polymer Network with both Good Mechanical and Damping Properties via Molecular Dynamics Simulation [O] . Zhiyu Zhang, Guanyi Hou, Jianxiang Shen, 2018

机译：通过分子动力学模拟设计具有良好机械和阻尼性能的滑环聚合物网络

Molecular Dynamics Simulation and Theoretical Model of Elasticity in Slide-Ring Gels

摘要

著录项

相似文献

相关主题

期刊订阅