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室温离子液体BMIGaCl4热力学性质研究
引用本文:许维国,吕兴梅, ,张庆国, ,桂劲松,杨家振. 室温离子液体BMIGaCl4热力学性质研究[J]. 中国化学, 2006, 24(3): 331-335. DOI: 10.1002/cjoc.200690063
作者姓名:许维国  吕兴梅     张庆国     桂劲松  杨家振
作者单位:[1]Department of Chemistry, Liaoning University, Shenyang, Liaoning 110036, China [2]The Institute of Salt Lakes, Chinese Academy of Sciences, Xining, Qinghai 810008, China [3]Department of Chemistry, Shenyang Normal University, Shenyang, Liaoning 110032, China
基金项目:Project supported by the National Natural Science Foundation of China (No. 20041005), and Education Bureau of Liaoning Province (No. 2021001281).
摘    要:An ionic liquid (IL) BMIGaCh was prepared by directly mixing GaCl3 and 1-methyl-3-butylimidazolium chloride with molar ratio of 1/1 under argon atmosphere. The densities and surface tensions of this pure ionic liquid were determined in the temperature range of 268.15 to (338.15±0.1) K. A new theoretical model of ionic liquids, an interstice model, was applied to calculate the thermal expansion coefficient of IL BMIGaCh, a, and the magnitude order of its value calculated by the theory was the same as experimental one. Both Raman scattering and ab initio calculations indicate that GaCl4^- is the only species containing Ga in the ionic liquid BMIGaCl4.

关 键 词:热力学性质 离子液体 BMIGaCl4 表面张力 氯化镓 拉曼光谱 从头计算
收稿时间:2005-04-19
修稿时间:2005-04-192005-11-09

Studies on the Thermodynamic Properties of the Ionic Liquid BMIGaCl4
Xu WeiGuo;Lv XingMei;Zhang QingGuo;Gui JinSong;Yang GuZhe. Studies on the Thermodynamic Properties of the Ionic Liquid BMIGaCl4[J]. Chinese Journal of Chemistry, 2006, 24(3): 331-335. DOI: 10.1002/cjoc.200690063
Authors:Xu WeiGuo  Lv XingMei  Zhang QingGuo  Gui JinSong  Yang GuZhe
Abstract:An ionic liquid (IL) BMIGaCl4was prepared by directly mixing GaCl3 and 1‐methyl‐3‐butylimidazolium chloride with molar ratio of 1/1 under argon atmosphere. The densities and surface tensions of this pure ionic liquid were determined in the temperature range of 268.15 to (338.15±0.1) K. A new theoretical model of ionic liquids, an interstice model, was applied to calculate the thermal expansion coefficient of IL BMIGaCl4, α, and the magnitude order of its value calculated by the theory was the same as experimental one. Both Raman scattering and ab initio calculations indicate that GaCl4? is the only species containing Ga in the ionic liquid BMIGaCl4.
Keywords:ionic liquid   density   surface tension   gallium chloride   Raman spectrum   ab initio calculation
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