Abstract
The phase equilibria behavior of simplified surfactant models and population of aggregates as a function of pressure were discussed. The Monte Carlo simulation results of the systems were compared with predictions from a modified version of the statistical associating fluid theory (soft-SAFT). The influence of the number and location of the association sites on the thermodynamic properties was analyzed. Analysis shows that the soft-SAFT was able to quantitatively predict the MC PVT results indepedently of the location of the association sites.
| Original language | English |
|---|---|
| Pages (from-to) | 9822-9830 |
| Number of pages | 9 |
| Journal | Journal of Chemical Physics |
| Volume | 120 |
| Issue number | 20 |
| DOIs | |
| Publication status | Published - 22 May 2004 |
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