表面张力
环氧乙烷
润湿
聚合物
吸附
分子动力学
溶剂
材料科学
化学工程
氧化物
粘附
高分子化学
化学物理
吉布斯等温线
热力学
化学
物理化学
计算化学
复合材料
有机化学
共聚物
物理
冶金
工程类
作者
Jianwei Zhang,Qian Lu,Jiajia Zhou,Guangzhao Zhang
标识
DOI:10.1021/acs.jpcb.3c01719
摘要
Surface tension plays a critical role in a wide range of fields such as adhesion, wetting, and capillarity. Herein, we combine experiments and molecular dynamics (MD) simulations to study the surface tension (γ) of poly(ethylene oxide) (PEO) solution as a function of its molecular weight (M). In experiments, we reveal that γ is scaled to M with |γ - γ∞| ∝ Mα up to a critical molecular weight (M*). Simulation with a coarse-grained polymer solution model shows that α decreases as the solvent quality becomes worse. The combination of the experiments and simulations reveal that α is slightly affected by PEO concentration. On the other hand, M* decreases as the solvent quality decreases or as the polymer concentration increases. Our study demonstrates that the surface tension of the polymer solution is determined by the adsorption of the polymer at the air-solution surface.
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