Prediction the Experimental Data of CO2 and H2S Solubility in Ionic Liquids Using PR-EoS with Three Different Mixing Rules

Shagull M. Ali, A. J. Hadi, Shahla Z. Ahmad
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Abstract

In this study, Peng-Robinson equations of state associated with three different mixing rules used to predict the experimental solubility data of two acid gases, carbon dioxide and hydrogen sulfide in seven ionic liquids. The solubility data were obtained from different literature in pressure range (0.119 – 65.2) bar and verity range of temperatures (298.2 – 353) K. Mixing rules, used the modified Van der Waal (MR1), the Quadratic (MR2) and the Wong Sandler (MR3). The ionic liquids critical properties were correlated by modified Lydersen-Joback-Reid technique. The Average Absolute Relative Deviation (%AARD) was applied to compare the experimental data and that obtained from the model. The evaluated critical properties give a very close result with the literature. The mathematical model in almost systems using the three mixing rule gives good agreement with experimental data only in H2S - ILs systems gives very high deviation from the experimental data when use MR3. Quadratic mixing rule (MR2) was the best comparing with MR1 and MR3, give the lowest range %AARD 0.9 to 21.  
用PR-EoS预测三种不同混合规则下离子液体中CO2和H2S溶解度的实验数据
在本研究中,使用了与三种不同混合规则相关的Peng-Robinson状态方程来预测二氧化碳和硫化氢两种酸性气体在七种离子液体中的溶解度数据。在压力范围(0.119 ~ 65.2)bar和温度范围(298.2 ~ 353)k下的溶解度数据来自不同的文献,混合规则采用改进的Van der Waal (MR1),二次型(MR2)和Wong Sandler (MR3)。采用改进的Lydersen-Joback-Reid技术对离子液体的临界性质进行了相关性分析。采用平均绝对相对偏差(%AARD)对实验数据与模型计算结果进行比较。所评估的临界性质与文献的结果非常接近。采用三混合规则的系统数学模型与实验数据吻合较好,只有在H2S - ILs系统中使用MR3时与实验数据偏差很大。与MR1和MR3相比,二次混合规则(MR2)效果最好,最低范围%AARD为0.9 ~ 21。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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