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Lattice fluid model generalized for specific interactions: An application to ternary polymer solutions

机译:适用于特定相互作用的晶格流体模型:在三元聚合物溶液中的应用

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摘要

The phase diagram of the Poly- l-Lactic-Acid (PLLA), dioxane and water system was derived by using the lattice fluid model generalized for specific interactions. A qualitative analysis of Hansen solubility parameters together with empirical observations were adopted to reduce the number of adjustable parameters. The as-selected model parameters were derived by fitting a set of cloud point curves; consequently, the complete phase diagram of the system was computed. The use of specific interactions between species gave out a quantitative agreement with a set of experimental data, whereas changing the polymer polydispersity the agreement is only qualitative. In principle, the presented procedure could be adopted for the calculation of liquid-liquid equilibria in ternary polymer solutions with similar features of PLLA-dioxane-water system.
机译:聚乳酸乳酸(PLLA),二恶烷和水系统的相图是通过使用针对特定相互作用而推广的晶格流体模型得出的。通过对Hansen溶解度参数进行定性分析和经验观察,减少了可调参数的数量。选定的模型参数是通过拟合一组浊点曲线得出的。因此,计算了系统的完整相图。物种之间特定相互作用的使用给出了一组实验数据的定量一致性,而改变聚合物的多分散性仅是定性的。原则上,所提出的程序可用于计算具有PLLA-二恶烷-水系统相似特征的三元聚合物溶液中的液-液平衡。

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