Study of Winsor I to Winsor II transitions in a lattice model.
Experiments show that with increasing temperature, microemulsion systems undergo Winsor transitions. The transitions occur from Winsor I (oil droplets in water media) to Winsor II (water droplets in oil media) via Winsor III (bicontinuous phase) with an increase in the temperature. In this paper, it has been shown, for the first time, how one can study the qualitative effects of temperature, head, tail, and oil chain lengths, on these transitions. Simple cubic lattice with excluded volume and periodic boundary conditions is used to mimic the box of the simulation as a bulk of solution. The simulations have been done using the standard traditional Metropolis algorithm in the canonical ensemble (N, V, T). Configurational bias Monte Carlo and reptation moves are used with an equal probability to relax the systems. A very simple interaction model, i.e., the repulsions of water (or heads of surfactants) with oil (or tails of surfactants), is used due to the main characteristic of oil-water mixtures or amphiphilic molecule that is the hydrophobicity. The interfacial tension between oil and water (gammaow) is related to the averaged total energy of the lattice. The model shows that the Winsor III has a minimum interfacial tension (gammaow) similar to experimental results. Changing the phase structure from Winsor III to Winsor I (or Winsor II), increases the interfacial tension which is in agreement with experiments. To relate interfacial tension with the interaction parameter, the simple theory of Bragg-Williams has been used. All of the results such as the effects of oil chain length, head and tail beads number are all similar to the experimental results. Using the Davies method for calculating hydrophilic-lypophilic Balance (HLB), similar to the experimental results, Winsor III phase is formed at HLB value nearly to 10.
Behjatmanesh-Ardakani
Reza
R
Department of Chemistry, School of Science, Payame-Noor University of Ardakan, Ardakan, Yazd, Iran. reza_b_m_a@yahoo.com
Nikfetrat
Mehdi
M
D057927:Hydrophobic and Hydrophilic Interactions; D008956:Models, Chemical; D009821:Oils / Q000737:chemistry; D013501:Surface-Active Agents / Q000737:chemistry; D013696:Temperature; D014867:Water / Q000737:chemistry
D009821:Oils; D013501:Surface-Active Agents; D014867:Water