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Equilibrium, dynamic and simulation studies of AOT reverse micellar, carbon black and fullerene colloidal systems.

机译:AOT反胶束,炭黑和富勒烯胶体系统的平衡,动态和仿真研究。

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摘要

Equilibrium and dynamic studies were performed on the association colloidal system AOT/water in the nonpolar solvent CCl{dollar}sb4{dollar} to study the effect of solubilized water on the size, shape and interaction properties of the reverse micelles. The hydrodynamic diameters determined by viscosity and dynamic light scattering were found in good agreement with each other and with other experimental data. Electric field-induced birefringence measurements showed negative birefringence. The measured and calculated relaxation times indicated the presence of inter-micellar interactions.; Atomic level molecular simulations with the ESFF forcefield were used to identify the most stable geometries of the AOT molecule in vacuum, water and CCl{dollar}sb4.{dollar} In this approximation, the energies of interaction between AOT and individual water molecules were determined. Calculated geometrical parameters of the AOT molecule were applied toward the estimation of the size and aggregation number of reverse micelles, and were found in good agreement with experiments.; The dispersion colloid systems N660 and N299 carbon black suspensions and fullerene aggregates were studied by performing viscosity as well as dynamic and static light scattering measurements. Stability properties, size distribution and deviation from the spherical shape were analyzed. Close to equilibrium, dynamic measurements indicated positive birefringence for all three systems. Perturbation by high-energy laser pulses resulted in non-linear behavior for the carbon black samples. A characteristic signature peak of C{dollar}sb{lcub}60{rcub}{dollar} was identified in the UV-vis spectrum of N660.
机译:在非极性溶剂CCl {dol} sb4 {dollar}中对胶体体系AOT /水的缔合进行了平衡和动力学研究,以研究溶解水对反胶束的大小,形状和相互作用特性的影响。发现由粘度和动态光散射确定的流体力学直径彼此之间以及与其他实验数据非常吻合。电场诱导的双折射测量结果显示为负双折射。测量和计算的弛豫时间表明胶束间相互作用的存在。使用ESFF力场进行原子级分子模拟,以鉴定真空,水和CCl中最稳定的AOT分子几何形状{dollar} sb4 {dollar}。在这种近似中,确定了AOT与各个水分子之间相互作用的能量。 。将计算出的AOT分子的几何参数用于反胶束的大小和聚集数的估计,发现与实验吻合良好。通过进行粘度以及动态和静态光散射测量,研究了分散体胶体体系N660和N299炭黑悬浮液以及富勒烯聚集体。分析了稳定性,尺寸分布和偏离球形。接近平衡时,动态测量表明所有三个系统的正双折射。高能激光脉冲的扰动导致炭黑样品发生非线性行为。在N660的UV-可见光谱中鉴定出C {dolb} sb {lcub} 60 {rcub} {dollar}的特征性特征峰。

著录项

  • 作者

    Derecskei, Bela.;

  • 作者单位

    The University of Texas at Arlington.;

  • 授予单位 The University of Texas at Arlington.;
  • 学科 Chemistry Biochemistry.
  • 学位 Ph.D.
  • 年度 1998
  • 页码 109 p.
  • 总页数 109
  • 原文格式 PDF
  • 正文语种 eng
  • 中图分类 生物化学;
  • 关键词

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