有机合成(108) 离子液体(441) 催化(166) 离子液体制备(12) 离子液体物性数据(10) 纳米(30) 分离过程(14) 综述(5) 电化学(57) 离子液体纯化(1) 气体处理(17) 荧光(4) 脱硫(1) 催化制氢(1) 太阳能电池(1) 离子液体性能研究(20) 变焦透镜(6) 纤维素溶解(6) 离子液体理论研究(4) 润滑(10) 添加剂(4) 溶剂(38) 气体压缩(1) 功能材料(42) 脱酸工艺(1) 产业化(30) 物化性质研究(2) 新能源(9) 新型离子液体(11) 会议(18) 分析检测(3) 电池(29) 空间技术(9) 高极性色谱柱(1) 离子液体市场分析(1) 电子技术(6) 生物相容性(9) 分析测试(16) 缩微实验室(1)
您当前的位置:首页 > TAG信息列表 > 离子液体理论研究
- Ionic liquid-gas interfaces: more than a surface glance
- 更新时间:2014-12-30;信息类型:国外研究进展
- Research by scientists in the UK suggests that small changes in the nature of binary ionic liquid systems can significantly alter their surface composition. The findings may aid the design of ionic liquid films for applications such as gas capture and supported catalysis, where surface adsorption is essential.
- 链接地址:http://www.ionike.com/research/2014-12-30/349.html
- 青海省盐化工中心“类离子液体基础理论研究”达到国际先进水平
- 更新时间:2014-09-04;信息类型:国内研究进展
- 日前,中国科学院青海盐湖研究所和青海省盐化工产品质量监督检验中心完成的“类离子液体基础理论研究”项目通过成果评价,研究成果达到国际先进水平。
- 链接地址:http://www.ionike.com/research/2014-09-04/336.html
- Intrinsic Electric Fields in Ionic Liquids Determined by Vibrational Stark Effect Spectroscopy and Molecular Dynamics Simulation
- 更新时间:2014-04-10;信息类型:SCI论文
- ★★★★☆ Zhang SG,Shi R,Ma XY,et al. Intrinsic Electric Fields In Ionic Liquids Determined By Vibrational Stark Effect Spectroscopy And Molecular Dynamics Simulation[J]. Chem. Eur. J.,2012,18:11904-11908.
- 链接地址:http://www.ionike.com/download/article/2014-04-10/164.html
- Investigation of cation–anion interaction in 1-(2-hydroxyethyl)-3-methylimidazolium-based ion pairs by density functional theory calculations and experiments
- 更新时间:2014-04-10;信息类型:SCI论文
- Gas-phase structure, hydrogen bonding, and cation–anion interactions of a series of 1-(2-hydroxyethyl)-3- methylimidazolium ([HOEMIm]+)-based ionic liquids (hereafter called hydroxyl ILs) with different anions (X=[NTf2]–, [PF6]–, [ClO4]–, [BF4]–, [DCA]–, [NO3]–, [AC]– and [Cl]–), as well as 1-ethyl-3-methylimizolium ([EMIm]+)-based ionic liquids (hereafter called nonhydroxyl ILs), were investigated by density functional theory calculations and experiments. Electrostatic potential surfaces and optimized structures of isolated ions, and ion pairs of all ILs have been obtained through calculations at the Becke, three-parameter, Lee–Yang–Parr/6-31+G(d,p) level and their hydrogen bonding behavior was further studied by the polarity and Kamlet–Taft Parameters, and 1H-NMR analysis. In [EMIm]+-based nonhydroxyl ILs, hydrogen bonding preferred to be formed between anions and C2–H on the imidazolium ring, while in [HOEMIm]+-based hydroxyl ILs, it was replaced by a much stronger one that preferably formed between anions and OH. The O–H___X hydrogen bonding is much more anion-dependent than the C2–H___X, and it is weakened when the anion is changed from [AC]– to [NTf2]–. The different interaction between [HOEMIm]+ and variable anion involving O–H___X hydrogen bonding resulted in significant effect on their bulk phase properties such as 1H-NMR shift, polarity and hydrogen-bond donor ability (acidity, a).
- 链接地址:http://www.ionike.com/download/article/2014-04-10/155.html