Article ID Journal Published Year Pages File Type
6466832 Chemical Engineering Science 2017 17 Pages PDF
Abstract

•Phase-field simulations for polymer/solvent system.•Significant influence of the mobility model on the pattern evolution.•Growth laws close to Lc∼t1/3 whatever the quenching conditions for constant mobility.•Growth laws between Lc∼t1/5 and Lc∼t1/3 for non-constant mobilities, depending on the quenching conditions.•Pattern analysis using the Minkowski descriptors.

This paper presents a phase-field simulation of phase separation for a polymer/solvent system and aims at investigating in a systematic way the influence of the mobility model on the simulation results. In 2D geometry, the Flory-Huggins theory was used to describe the thermodynamics of the PMMA/cyclohexanol system and four mobility models were tested: a constant model, a slow model, a fast model and a mobility model based on the free-volume theory of Vrentas. The simulated patterns were analyzed by Fourier transform and using Minkowski descriptors. Growth laws deduced from a Fourier Transform of the patterns exhibited that the power laws were ranged between 1/5 and 1/3 depending on the quenching conditions (T and initial composition) and the mobility model. Using the Vrentas mobility model, growth laws of Lc∼t1/5, Lc∼t1/4 and Lc∼t1/3 were found for initial compositions in the range ϕinit=0.075, 0.140 and 0.200, respectively, whereas due to faster phase inversion dynamics, a growth law close to Lc∼t1/3 was simulated for the constant mobility model whatever the quenching conditions (T and initial composition), thus demonstrating the importance to choose an appropriate mobility model for simulating the phase separation of polymer/solvent system.

Related Topics
Physical Sciences and Engineering Chemical Engineering Chemical Engineering (General)
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