Molecular dynamics study of the effect of sodium and chloride ions on water-surfactant-hydrocarbon interfaces
Abstract
Molecular dynamic simulations have been performed to study the effect of electrolyte concentrations and temperature on the structural, dynamic, and thermal properties of cationic surfactants at the water/n-decane interface. Results show that optimal salinity (where the interfacial tension (IFT) passes through a minimum) could be reached for erucylbis-(hydroxyethyl)-methylammonium chloride (EHAC). In contrast, the IFT of cetyltrimethylammonium...
Paper Details
Title
Molecular dynamics study of the effect of sodium and chloride ions on water-surfactant-hydrocarbon interfaces
Published Date
Aug 1, 2021
Journal
Volume
548
Pages
111243 - 111243
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