节点文献

三元链状分子系统液液平衡的计算机模拟

COMPUTER SIMULATION OF LIQUID-LIQUID EQUILIBRIA FOR TERNARY CHAIN MOLECULES

  • 推荐 CAJ下载
  • PDF下载
  • 不支持迅雷等下载工具,请取消加速工具后下载。

【作者】 姜建文严琪良刘洪来胡英

【Author】 Jiang Jianwen;Yan Qiliang;Liu Honglai;Hu Ying(Department of Chemistry,East China University of Science and Technology,Shanghai 200237)

【机构】 华东理工大学化学系!上海200237

【Abstract】 By applying the configuration-bias vaporization method for the simulation of hquid-hquid equilibria based on lattice model,the liquid-liquid equilibria of three ternary systems with the specified molecular parameters(r1=1,r2=4,r3=8,ε12=0.333,ε13= 0.556,ε23=00),(r1=1,r2=4,r3=l6,ε12=0.25,εl3=0.50,ε23=-0.10)and(r1=1,r2=4,r3=32,εl2=0.25,ε13=0.50,ε23=-0.10),respectively,are obtained.Comparisons between the simulation results and those calcu1ated by Flory-Huggins theory,Freed theory and Hu et el’s model for the Polymer solution are made.It is shown that Flory-Huggins theory have large deviation from simulated results,while Freed theory and Hu et al’s model gives much better results.

【基金】 国家自然科学基金
  • 【文献出处】 化工学报 ,Journal of Chemical Industry and Engineering(China) , 编辑部邮箱 ,1996年05期
  • 【分类号】O642
  • 【被引频次】5
  • 【下载频次】55
节点文献中: 

本文链接的文献网络图示:

本文的引文网络