Prediction of the binary surface tension of mixtures containing ionic liquids using Support Vector Machine algorithms

被引:52
|
作者
Hashemkhani, Mohammad [1 ]
Soleimani, Reza [2 ]
Fazeli, Hossein [3 ]
Lee, Moonyong [4 ]
Bahadori, Alireza [5 ]
Tavalaeian, Mahsa [6 ]
机构
[1] PUT, Ahwaz Fac Petr Engn, Ahvaz, Iran
[2] Islamic Azad Univ, Neyshabur Branch, Young Researchers & Elite Club, Neyshabur, Iran
[3] Univ Oslo, Dept Geosci, Oslo, Norway
[4] Yeungnam Univ, Sch Chem Engn, Gyeungsan, South Korea
[5] So Cross Univ, Sch Environm Sci & Engn, Lismore, NSW 2480, Australia
[6] Univ Zanjan, Dept Phys, Zanjan, Iran
关键词
Ionic liquids; Surface tension; Binary mixtures; Prediction; Support Vector Machine; ARTIFICIAL NEURAL-NETWORK; AQUEOUS BIPHASIC SYSTEMS; CARBON-DIOXIDE; THERMOPHYSICAL PROPERTIES; THERMODYNAMIC PROPERTIES; ELECTRICAL-CONDUCTIVITY; PHASE-EQUILIBRIUM; TERNARY MIXTURES; HEURISTIC METHOD; H2S SOLUBILITY;
D O I
10.1016/j.molliq.2015.07.038
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 surface tension of pure ionic liquids (ILs) and their mixtures with other compounds play a key role in the design and development of many industrial processes. Therefore, its modeling is extremely important from an industrial point of view. This study examined the capability and feasibility of three intelligence algorithms for predicting the surface tension of binary systems containing ILs. To construct and test the models, 748 data points corresponding to the experimental surface tension values of binary mixtures containing ILs were extracted from the literature. The surface tension was between 0.0157 and 0.07185 N . m(-1). The absolute temperature (T), mole fraction and molecular weight of the IL components (x(IL) and Mw(IL)) and the density of the IL components (rho(IL)) together with the boiling point (Tbnon-IL) and molecular weight (Mw(non-IL)) of the non-IL component were considered as model input variables to differentiate between the various compounds involved in binary systems. A comparison of the experimental data and predicted values using all three methods (in terms of statistical parameters) showed good agreement; however, the CSA-LSSVM prediction was better than the other two approaches. (C) 2015 Elsevier B.V. All rights reserved.
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页码:534 / 552
页数:19
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