耗散颗粒动力学模拟
材料科学
耗散系统
工作(物理)
粒子(生态学)
聚合物混合物
增容
块(置换群论)
聚合物
化学物理
共聚物
复合材料
热力学
高分子化学
化学
物理
数学
几何学
地质学
海洋学
作者
Tianhang Zhou,Jurek Schneider,Zhenghao Wu,Florian Müller‐Plathe
出处
期刊:Macromolecules
[American Chemical Society]
日期:2021-10-08
卷期号:54 (20): 9551-9564
被引量:7
标识
DOI:10.1021/acs.macromol.1c01076
摘要
We study the compatibilizing effect of copolymers of different architectures on the interface between two incompatible polymer phases by dissipative particle dynamics. Three base polymer systems are investigated, namely weakly incompatible (interspecies repulsion parameter of the dissipative particle dynamics interaction αAB: 25 < αAB < 30), intermediate-incompatible (30 ≤ αAB < 40), and strongly incompatible systems (αAB ≥ 40). We find that the compatibilization efficiency of all regular block copolymers in strongly incompatible systems can be predicted by a power-law function, which contains the Flory–Huggins interaction parameter, the areal concentration, and the mean block length of the compatibilizer. Regular multiblock copolymers have better compatibilization performance compared to the symmetric diblock copolymers at the same areal concentration. This is because smaller amounts of the multiblock copolymer are required to saturate a given interfacial area. For unsymmetric diblock copolymers in strongly incompatible systems, we find additionally that the length of the shortest block is a more important determinant for the compatibilization efficiency than the ratio of block lengths. Our work reveals the involved mechanisms of the compatibilization process, and it provides a promising route to predict the compatibilization efficiency of differently structured copolymer additives in the respective polymer blends.
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