A group contribution method for estimation of glass-transition temperature of 1,3-dialkylimidazolium ionic liquids

被引：19

作者：

Gharagheizi, Farhad ^{[1
]}

Keshavarz, Mohammad Hossein ^{[2
]}

Ilani-Kashkouli, Poorandokht ^{[1
]}

Farahani, Nasrin ^{[3
]}

Tumba, Kaniki ^{[4
]}

机构：

[1] Islamic Azad Univ, Buinzahra Branch, Dept Chem Engn, Buinzahra, Iran

[2] Malek Ashtar Univ Technol, Dept Chem, Esfahan, Iran

[3] Islamic Azad Univ, Buinzahra Branch, Dept Chem, Buinzahra, Iran

[4] Mangosuthu Univ Technol, Dept Chem Engn, Durban, South Africa

来源：

JOURNAL OF THERMAL ANALYSIS AND CALORIMETRY | 2013年 / 114卷 / 03期

关键词：

Glass-transition temperature; Ionic liquids; Group contribution; Reliable model; STRUCTURE-PROPERTY RELATIONSHIP; LOWER FLAMMABILITY LIMIT; NONELECTROLYTE ORGANIC-COMPOUNDS; GROUP-CONTRIBUTION MODEL; FLASH-POINT TEMPERATURE; QSPR MOLECULAR APPROACH; PURE COMPOUNDS; THERMODYNAMIC FUNCTIONS; STANDARD ENTHALPY; SURFACE-TENSION;

D O I：

10.1007/s10973-012-2907-0

中图分类号：

O414.1 [热力学];

学科分类号：

摘要：

Glass-transition temperature (T (g)) of ionic liquids (ILs) plays a key role in assessment of their potential for electrolyte application purposes. In this communication, a new group contribution model is presented for the prediction of the T (g) of 1,3-dialkylimidazolium, a class of ILs, which has great potentialities to serve as electrolyte. To develop this model, the contribution of ILs' anions and cations is separately considered. This simple model shows a low average relative deviation of 1.94 % for a data set including 109 experimental glass-transition temperature.

引用

页码：1363 / 1382

页数：20

共 87 条

[1] Thermal properties of sulfonic acid group functionalized Bronsted acidic ionic liquids
Amarasekara, Ananda S.
Owereh, Onome S.
[J]. JOURNAL OF THERMAL ANALYSIS AND CALORIMETRY, 2011, 103 (03) : 1027 - 1030
[2] Thermal study and evaluation of new menthol-based ionic liquids as polymeric additives
Andrade, Carlos Kleber Z.
Matos, Ricardo Alexandre F.
Oliveira, Viviane B.
Duraes, Jussara A.
Sales, Maria J. A.
[J]. JOURNAL OF THERMAL ANALYSIS AND CALORIMETRY, 2010, 99 (02) : 539 - 543
[3] Angell C.A., 2004, Encyclopedia of Materials: Science and Technology, P1
[4] [Anonymous], ENCY ELECTROCHEMICAL
[5] [Anonymous], E POLYM
[6] [Anonymous], 2000, ULLMANNS ENCY IND CH
[7] [Anonymous], 1984, Multivariate Observations, DOI DOI 10.1002/9780470316641
[8] A statistical method for evaluation of the experimental phase equilibrium data of simple clathrate hydrates
Eslamimanesh, Ali
Gharagheizi, Farhad
Mohammadi, Amir H.
Richon, Dominique
[J]. CHEMICAL ENGINEERING SCIENCE, 2012, 80 : 402 - 408
[9] A simple correlation for prediction of heat capacities of ionic liquids
Farahani, Nasrin
Gharagheizi, Farhad
Mirkhani, Seyyed Alireza
Tumba, Kaniki
[J]. FLUID PHASE EQUILIBRIA, 2013, 337 : 73 - 82
[10] Ionic liquids: Prediction of melting point by molecular-based model
Farahani, Nasrin
Gharagheizi, Farhad
Mirkhani, Seyyed Alireza
Tumba, Kaniki
[J]. THERMOCHIMICA ACTA, 2012, 549 : 17 - 34

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