摘要
将Simha-Somcynsky状态方程引入到Vrentas-Duda扩散系数模型,建立基于状态方程的溶剂在高分子中扩散系数模型。与原模型相比,改进的模型避免进行高分子的黏弹性实验测定,模型中高分子的相关参数仅由状态方程的特征温度和特征体积确定,提高了模型的预测能力。对苯、甲苯、乙苯、氯仿在聚苯乙烯、聚异丁烯和聚醋酸乙烯酯中的扩散系数计算结果表明,改进模型的预测值与实验值吻合较好。
With the introduction of the Simha-Somcynsky （SS） equation-of-state （EOS） into the Vrentas-Duda model, a modified diffusion coefficient model based on the EOS was developed for polymersolvent systems. In the modified model, the measurement of polymer viscoelasticity was not required, and the parameters related to the polymer could be determined solely by the characteristic parameters of temperature and volume in the SS EOS. Therefore, it has better predictive capability compared with the original model. The calculated diffusion coefficients of benzene, toluene, ethylbenzene and chloroform in polystyrene, polyisobutylene and poly（vinyl acetate） indicated that predictions of the modified model were consistent with the experimental results.
出处
《化工学报》
EI
CAS
CSCD
北大核心
2007年第1期10-14,共5页
CIESC Journal
基金
国家自然科学基金项目(20276033
20276014)
国家重点基础研究发展计划项目(2003CB615701)~~
关键词
高分子
溶剂
扩散系数
状态方程
polymer
solvent
diffusion coefficient
equation-of-state （EOS）
