摘要
将前文导得的均聚硬球链流体的分子热力学模型推广应用到共聚硬球链及其混合流体。用本模型预测的纯共聚硬球链流体和均聚硬球链流体混合物的压缩因子与计算机模拟结果比较,两者能很好地相互吻合。为进一步构筑实际高分子溶液和共混物的分子热力学模型打下了良好的基础。
Previous molecular thermodynamic model based on the statistical theory of chemical association for pure homonuclear hard-sphere chain fluids has been extended to the mixture of heteronuclear hard-sphere chain fluids. Good agreement can be obtained by this model without any adjustable parameters compared with computer simulation results of the comprcssibility factors of heteronuclear hard-sphere chain fluids and their mixtures. The generalization presented here can be used to the mixtures of heteronuclear hard-sphere chain molecules differing among themselves in both the chain length and diameter of sphere segments. The model can be used as the basis of the molecular thermodynamic model for real polymer solution,polymer blend and copolymer systems.
出处
《华东理工大学学报(自然科学版)》
CAS
CSCD
1995年第5期619-625,共7页
Journal of East China University of Science and Technology
基金
国家自然科学基金
关键词
状态方程
高分子溶液
共聚物
硬球链流体
equation of state
polymer solution
copolymer
compressibility factor