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双分散缠结聚合物快速流动下剪切应力双峰的原始链网络模拟

Primitive Chain Network Simulations for Double Peaks in Shear Stress under Fast Flows of Bidisperse Entangled Polymers.

作者信息

Masubuchi Yuichi

机构信息

Department of Materials Physics, Nagoya University, Nagoya 464-8603, Japan.

出版信息

Polymers (Basel). 2024 May 21;16(11):1455. doi: 10.3390/polym16111455.

Abstract

A few experiments have reported that the time development of shear stress under fast-startup shear deformations exhibits double peaks before reaching a steady state for bimodal blends of entangled linear polymers under specific conditions. To understand this phenomenon, multi-chain slip-link simulations, based on the primitive chain network model, were conducted on the literature data of a bimodal polystyrene solution. Owing to reasonable agreement between their data and our simulation results, the stress was decomposed into contributions from long- and short-chain components and decoupled into segment number, stretch, and orientation. The analysis revealed that the first and second peaks correspond to the short-chain orientation and the long-chain stretch, respectively. The results also implied that the peak positions are not affected by the mixing of short and long chains, although the intensity of the second peak depends on mixing conditions in a complicated manner.

摘要

一些实验报告称,在特定条件下,对于缠结线性聚合物的双峰共混物,快速启动剪切变形下剪切应力的时间发展在达到稳态之前呈现双峰。为了理解这一现象,基于原始链网络模型进行了多链滑移连接模拟,以研究双峰聚苯乙烯溶液的文献数据。由于他们的数据与我们的模拟结果之间存在合理的一致性,应力被分解为长链和短链组分的贡献,并解耦为链段数、拉伸和取向。分析表明,第一个和第二个峰分别对应于短链取向和长链拉伸。结果还表明,尽管第二个峰的强度以复杂的方式取决于混合条件,但峰位置不受短链和长链混合的影响。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9032/11174453/f640f9ec684b/polymers-16-01455-g001.jpg

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