戒指(化学)
聚合物
材料科学
分子动力学
均方位移
质心(相对论)
扩散
链条(单位)
弯曲
流离失所(心理学)
化学物理
结晶学
高分子化学
复合材料
化学
计算化学
热力学
物理
机械
心理学
有机化学
能量-动量关系
天文
心理治疗师
作者
Xiao‐yue Han,Xiaolin Zhou,Xianghong Wang,Linli He
标识
DOI:10.1002/macp.202300131
摘要
Abstract Using coarse‐grained molecular dynamics simulations, the conformation and dynamic behavior of ring polymer chains in ring/linear blends confined into cylinders are studied. By changing the particle number density, polymer chain bending energy and length, the spatial distribution of rings in the constrained binary polymer blends is investigated. An ordered tubular structure composed of several quasi‐parallel rings is observed. The mean square displacement of the center‐of‐mass of ring chains and its diffusion coefficient are analyzed. The results indicate that the diffusion behavior of rings is transformed from inhibition to promotion as the increase of linear chain bending energy. This study provides a new way to further understand the special conformation and dynamic behavior of ring polymer chains in constrained systems.
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