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借助变阱宽方阱链流体状态方程模拟非电解质体系表面张力和粘度(英文)
引用本文:李进龙,何昌春,马俊,彭昌军,刘洪来,胡英. 借助变阱宽方阱链流体状态方程模拟非电解质体系表面张力和粘度(英文)[J]. 中国化学工程学报, 2011, 19(4): 533-543. DOI: 10.1016/S1004-9541(11)60018-9
作者姓名:李进龙  何昌春  马俊  彭昌军  刘洪来  胡英
作者单位:State Key Laboratory of Chemical Engineering and Department of Chemistry, East China University of Science and Technology, Shanghai 200237, China
基金项目:Supported by the National Natural Science Foundation of China (20776040, 20876041, 20736002); the National Basic Research Program of China (2009CB219902); the Program for Changjiang Scholars and Innovative Research Team in University of China (Grant IRT0721); the 111 Project (Grant B08021) of China
摘    要:The equation of state(EOS)for square-well chain fluid with variable range(SWCF-VR) developed in our previous work based on statistical mechanical theory for chemical association is employed for the correlations of surface tension and viscosity of common fluids and ionic liquids(ILs).A model of surface tension for multi-component mixtures is presented by combining the SWCF-VR EOS and the scaled particle theory and used to produce the surface tension of binary and ternary mixtures.The predicted surface tensions are in excellent agreement with the experimental data with an overall average absolute relative deviation(AAD)of 0.36%.A method for the calculation of dynamic viscosity of common fluids and ILs at high pressure is presented by combining Eyring’s rate theory of viscosity and the SWCF-VR EOS.The calculated viscosities are in good agreement with the experimental data with the overall AAD of 1.44% for 14 fluids in 84 cases.The salient feature is that the molecular parameters used in these models are self-consistent and can be applied to calculate different thermodynamic properties such as pVT,vapor-liquid equilibrium,caloric properties,surface tension,and viscosity.

关 键 词:表面张力  动态粘度  状态方程  流体  相互作用  非电解质  建模  系统
收稿时间:2010-11-04
修稿时间:2010-5-21 

Modeling of Surface Tension and Viscosity for Non-electrolyte Systems by Means of the Equation of State for Square-well Chain Fluids with Variable Interaction Range
Jinlong LI,Changchun HE,Jun MA,Changjun PENG,Honglai LIU,Ying HU. Modeling of Surface Tension and Viscosity for Non-electrolyte Systems by Means of the Equation of State for Square-well Chain Fluids with Variable Interaction Range[J]. Chinese Journal of Chemical Engineering, 2011, 19(4): 533-543. DOI: 10.1016/S1004-9541(11)60018-9
Authors:Jinlong LI  Changchun HE  Jun MA  Changjun PENG  Honglai LIU  Ying HU
Affiliation:State Key Laboratory of Chemical Engineering and Department of Chemistry, East China University of Science and Technology, Shanghai 200237, China
Abstract:The equation of state (EOS) for square-well chain fluid with variable range (SWCF-VR) developed in our previous work based on statistical mechanical theory for chemical association is employed for the correlations of surface tension and viscosity of common fluids and ionic liquids (ILs). A model of surface tension for multi-component mixtures is presented by combining the SWCF-VR EOS and the scaled particle theory and used to produce the surface tension of binary and ternary mixtures. The predicted surface tensions are in excellent agreement with the experimental data with an overall average absolute relative deviation (AAD) of 0.36%. A method for the calculation of dynamic viscosity of common fluids and ILs at high pressure is presented by combining Eyring's rate theory of viscosity and the SWCF-VR EOS. The calculated viscosities are in good agreement with the experimental data with the overall AAD of 1.44% for 14 fluids in 84 cases. The salient feature is that the molecular parameters used in these models are self-consistent and can be applied to calculate different thermodynamic properties such as pVT, vapor-liquid equilibrium, caloric properties, surface tension, and viscosity.
Keywords:surface tension   viscosity   equation of state   square-well chain   scaled particle theory   Eyring's theory   ionic liquid
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