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1. 中国科学院化学研究所 高分子物理与化学国家重点实验室,北京,100190
2. 中国科学院大学,北京,100049
纸质出版日期:2014-1-20,
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杨科大, 郭洪霞. 基于黏弹模型的聚合物溶液相分离的三维数值模拟[J]. 高分子学报, 2014,(1):88-98.
Ke-da Yang, Hong-xia Guo. Three-dimentional Numerical Simulations of Viscoelastic Phase Seperation in Polymer Solutions[J]. Acta Polymerica Sinica, 2014,(1):88-98.
杨科大, 郭洪霞. 基于黏弹模型的聚合物溶液相分离的三维数值模拟[J]. 高分子学报, 2014,(1):88-98. DOI: 10.3724/SP.J.1105.2014.13171.
Ke-da Yang, Hong-xia Guo. Three-dimentional Numerical Simulations of Viscoelastic Phase Seperation in Polymer Solutions[J]. Acta Polymerica Sinica, 2014,(1):88-98. DOI: 10.3724/SP.J.1105.2014.13171.
利用GPU加速技术实现黏弹模型的三维数值模拟,系统研究了中等浓度聚合物溶液的分相形貌和相分离动力学.模拟结果表明本体应力的不对称是体系出现相反转的重要原因.与实验观察的聚合物溶液相反转的演化过程一致,首先聚合物富集相形成网络结构,然后聚合物网络收缩断网,最后变为离散的液滴相.本体松弛模量的增加,一方面会抑制相分离初期的浓度涨落,导致相反转发生时间延迟;另一方面在相分离后期有助于形成大的聚合物富集液滴相,加速相区增长.剪切松弛模量的增加只有助于聚合物富集相保持网络结构,并在剪切松弛模量较大的情况下,不规则相结构的缓慢松弛导致了剪切应力在相分离后期长期存在.
The morphology and dynamics of viscoelastic phase separation in polymer solutions are investigated by the use of a graphic process unit (GPU) accelerated three-dimensional numerical simulation of a viscoelastic model for the first time.The results show the bulk stress is a prerequisite to the phase inversion.In agreement with the phase inversion observed in previous experiments
the polymer rich domain first forms a continuous network structure and then shrinks and inverts to a dispersed droplet structure.Interestingly
the growth of the bulk relaxation modulus suppresses the concentration fluctuation in the early stage of phase separation
and the phase inversion is thus delayed by the increase of bulk relaxation modulus.On the other hand
the growth of the bulk relaxation modulus increases the domain growth rate in the late stage of phase separation and leads to larger-sized polymer rich domains.Additionally
the growth of the shear relaxation modulus can help polymer rich domains to maintain network-like structures
and in the case of a larger shear relaxation modulus
the shear stress can exist for a longer time due to the slow relaxation of irregular polymer-rich domains in the late stage of phase separation.
黏弹模型聚合物溶液黏弹性相分离三维数值模拟
Viscoelastic ModelPolymer solutionViscoelastic phase separationThree-dimensional numerical simulation
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