Stability and Comparative Analysis of AOT/Water/Isooctane Reverse Micelle System Using Dynamic Light Scattering and Molecular Dynamics

V. R. Vasquez*, B. C. Williams, and O. A. Graeve*
Chemical and Materials Engineering, University of Nevada, Reno, Reno, Nevada 89557, United States
Kazuo Inamori School of Engineering, Alfred University, Alfred, New York 14802, United States
J. Phys. Chem. B, 2011, 115 (12), pp 2979–2987
DOI: 10.1021/jp109202f
Publication Date (Web): March 8, 2011
Copyright © 2011 American Chemical Society
*E-mail: (V.R.V.) victor.vasquez@unr.edu; (O.A.G.) graeve@alfred.edu. Telephone: +775 784 6060. Fax: +775 784 4764.

Abstract

Abstract Image

We use molecular dynamics (MD) and dynamic light scattering (DLS) measurements to analyze the size of reverse micellar structures in the AOT−water−isooctane system at different water-to-surfactant ratios at ambient temperature and pressure. We find good qualitative agreement for the size and morphology behavior of the reverse micelle structures between molecular dynamics calculations and DLS measurements; however, the average values for the reverse micelle size distributions are systematically larger for the DLS measurements. The latter tends to capture the average hydrodynamic size of the structures based on self-diffusion rather than the average physical size as measured in MD simulations, explaining the systematic deviations observed. The combination of MD with DLS allows a better interpretation of the experimental results, in particular for conditions where the structures are nonspherical, commonly observed at lower water-to-surfactant ratios. We also present and analyze the effect of zirconyl chloride on the micellar size distributions in this system. These type of salts are common for reverse micellar synthesis processes. We find that zirconyl chloride affects significantly the size distributions.

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    Dynamics of Water-in-Oil Nanoemulsions Revealed by Fluorescence Lifetime Correlation Spectroscopy

    Angel Orte, Maria J. Ruedas-Rama, Jose M. Paredes, Luis Crovetto, and Jose M. Alvarez-Pez
    Langmuir2011 27 (21), 12792-12799
    • Dynamics of Water-in-Oil Nanoemulsions Revealed by Fluorescence Lifetime Correlation Spectroscopy

      Angel Orte, Maria J. Ruedas-Rama, Jose M. Paredes, Luis Crovetto, and Jose M. Alvarez-Pez
      Langmuir2011 27 (21), 12792-12799

      The size, diffusional properties, and dynamics of reverse water-in-oil nanoemulsions, or reverse micelles (RMs), have been widely investigated because of interest in this system as a model for biological compartmentalization. Here, we have employed ...

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History

  • Published In Issue March 31, 2011
  • Article ASAPMarch 08, 2011
  • Received: May 28, 2010
    Revised: December 27, 2010

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