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Self-diffusion in asymmetric ring-linear blends

机译:不对称环-线性共混物中的自扩散

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We use the bond-fluctuation model to measure self-diffusivity of asymmetric blends of cyclic and linear polymers, where the number of monomers in the cyclic and linear polymer are different. We consider two series of asymmetric blends and vary the relative composition. In particular, N_C = 300 and N_L = 150, and N_C = 150 and N_L = 300, where N_C and N_L are the number of monomers in the cyclic and linear polymers, respectively. Compared to cyclic polymers, the self-diffusivity of linear polymers is relatively insensitive to the blend composition, and is approximately within a factor of two of the pure linear self-diffusivity. In sharp contrast, the self-diffusivity of cyclic polymers exhibits a strong "order of magnitude" variation with the blend microenvironment. The latter data appear to be consistent with trends expected from previous simulations of symmetric cyclic-linear blends, as a function of the fraction of linear polymer.
机译:我们使用键涨落模型来测量环状和线性聚合物的不对称共混物的自扩散性,其中环状和线性聚合物中单体的数量不同。我们考虑两种不对称共混物,并改变其相对组成。特别地,N_C = 300和N_L = 150,并且N_C = 150和N_L = 300,其中N_C和N_L分别是环状和线性聚合物中的单体数目。与环状聚合物相比,线性聚合物的自扩散性对共混物的成分相对不敏感,大约在纯线性自扩散性的两倍之内。与之形成鲜明对比的是,环状聚合物的自扩散性随共混物微环境表现出很强的“数量级”变化。后者的数据似乎与先前对对称环状-线性共混物的模拟所预期的趋势一致,后者是线性聚合物分数的函数。

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