Modeling solubilities of subcritical and supercritical fluids in polymers with cubic and non-cubic equations of state

被引:40
作者
Chen, Zhen-hua [1 ]
Cao, Kun [1 ,2 ]
Yao, Zhen [1 ]
Huang, Zhi-ming [1 ]
机构
[1] Zhejiang Univ, Dept Chem Engn, Inst Polymerizat & Polymer Engn, State Key Lab Chem Engn ZJU, Hangzhou 310027, Zhejiang, Peoples R China
[2] E China Univ Sci & Technol, Sch Chem Engn, UNILAB Res Ctr Chem React Engn, State Key Lab Chem Engn ECUST, Shanghai 200237, Peoples R China
基金
中国国家自然科学基金;
关键词
Equation of state; Solubility; Subcritical fluid; Supercritical fluid; Polymer; DIRECTIONAL ATTRACTIVE FORCES; PRESSURE-VOLUME-TEMPERATURE; OF-STATE; CARBON-DIOXIDE; PERTURBATION-THEORY; STATISTICAL THERMODYNAMICS; SEMICRYSTALLINE POLYMERS; DIFFUSION-COEFFICIENTS; DENSITY POLYETHYLENE; GAS SOLUBILITIES;
D O I
10.1016/j.supflu.2008.12.013
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The original statistical associating fluid theory (CK-SAFT), Perturbed-Chain SAFT (PC-SAFT), Sanchez-Lacombe (SL) and Sako-Wu-Prausnitz (SWP) equations of state (EoS) are used to model the solubilities of subcritical and supercritical fluids such as N-2, C2H4, C4H10, iso-C4H10, CO2 in molten, thermally softened or semicrystalline polymers. Classical van der Waals one-fluid mixing rule with only one adjustable binary parameter is used for all the models. Modeling results are compared with the experimental data for 21 binaries including 78 systems published in open literature. Good agreement can be obtained with the PC-SAFT and SL EoS where the polymers are molten or thermally softened. Moreover, SL EoS gives a reasonable representation of the sorption data for semicrystalline polymers but the results are less satisfactory when compared with amorphous polymer systems. The performance of the CK-SAFT is least satisfactory in mose case. Furthermore, SWP EoS provides an encouraging results although it is only a simple cubic equation of state. (C) 2009 Elsevier B.V. All rights reserved.
引用
收藏
页码:143 / 153
页数:11
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