Computer Simulation of Luminophore Solubilization in Reverse Micelles

Computer Simulation of Luminophore Solubilization in Reverse Micelles The solubilization of ionic (sodium naphthalene-2,6-disulfonate) and nonionic (diethyl 2,5-dihydroxyterephthalate) organic luminophores in water–isooctane–NaАОТ (sodium 1,4-bis[(2-ethylhexyl) oxy]-1,4-dioxybutane-2-sulfonate) reverse micelles is simulated by the molecular dynamics method. In a stationary state, the localization of luminophore molecules in a micelle appears to be the same irrespective of their initial positions in the system. The position and orientation of solubilized luminophores relative to a reverse micelle depend on the hydrophobicity and the capability for dissociation of the functional groups of their molecules, the size of the reverse micelle, and the structure of its electrical double layer. http://www.deepdyve.com/assets/images/DeepDyve-Logo-lg.png Colloid Journal Springer Journals

Computer Simulation of Luminophore Solubilization in Reverse Micelles

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Publisher
Springer Journals
Copyright
Copyright © 2018 by Pleiades Publishing, Ltd.
Subject
Chemistry; Polymer Sciences; Surfaces and Interfaces, Thin Films
ISSN
1061-933X
eISSN
1608-3067
D.O.I.
10.1134/S1061933X18030067
Publisher site
See Article on Publisher Site

Abstract

The solubilization of ionic (sodium naphthalene-2,6-disulfonate) and nonionic (diethyl 2,5-dihydroxyterephthalate) organic luminophores in water–isooctane–NaАОТ (sodium 1,4-bis[(2-ethylhexyl) oxy]-1,4-dioxybutane-2-sulfonate) reverse micelles is simulated by the molecular dynamics method. In a stationary state, the localization of luminophore molecules in a micelle appears to be the same irrespective of their initial positions in the system. The position and orientation of solubilized luminophores relative to a reverse micelle depend on the hydrophobicity and the capability for dissociation of the functional groups of their molecules, the size of the reverse micelle, and the structure of its electrical double layer.

Journal

Colloid JournalSpringer Journals

Published: Jun 1, 2018

References

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