...
首页> 外文期刊>Journal of molecular modeling >Effect of external static electric fields on the dynamic heterogeneity of ionic liquids
【24h】

Effect of external static electric fields on the dynamic heterogeneity of ionic liquids

机译:外部静电场对离子液体动态异质性的影响

获取原文
获取原文并翻译 | 示例
   

获取外文期刊封面封底 >>

       

摘要

Ionic liquids (ILs) exhibit behavior analogous to supercooled liquids at room or even higher temperatures. ILs usually work under an externally applied static electric field ( E ). In this work, molecular dynamics simulations were performed with 1-ethyl-3-methyl-imidazolium tetrafluorborate ([EMI_(+)][BF~(4)_(?)]) under E , with the aim of discovering the influence of E on the dynamic heterogeneity of ILs. ILs show more homogeneous dynamics with increasing E , as indicated by non-Gaussian parameters and dynamic susceptibility. The dynamic heterogeneity is greater in the E direction than that in the perpendicular directions under the same E . Despite the dynamic heterogeneity, only a small decoupling between diffusion and relaxation is observed under E .
机译:离子液体(ILS)表现出类似于房间或甚至更高温度的过冷液体的行为。 ILS通常在外部应用的静电场(E)下工作。 在这项工作中,用1-乙基-3-甲基 - 咪唑鎓四氟硼酸氢硼酸氢硼酸钡进行分子动力学模拟([EMI _(+)] [BF〜(4)_(α)]),目的是发现影响的影响 E对ILS的动态异质性。 ILS显示出更均匀的动态,增加E,如非高斯参数和动态易感性所示。 在E方向上的动态异质性比在相同e下方的垂直方向上更大。 尽管存在动态异质性,但在e下观察到扩散和弛豫之间的小耦合。

著录项

相似文献

  • 外文文献
  • 中文文献
  • 专利
获取原文

客服邮箱:kefu@zhangqiaokeyan.com

京公网安备:11010802029741号 ICP备案号:京ICP备15016152号-6 六维联合信息科技 (北京) 有限公司©版权所有
  • 客服微信

  • 服务号