| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 204151 | Fluid Phase Equilibria | 2008 | 8 Pages |
Mixtures of water with alcohol are important in numerous engineering applications. Caused by the polarity of water and alcohol self-association of water and alcohol as well cross-association between water and alcohol appear in such complex mixtures. These features show significant impact on physical and chemical properties, especially phase equilibrium behaviour and hence interfacial properties. The Cahn–Hilliard theory was combined with original statistical associated fluid theory equation of states (SAFT EOS) in order to describe both the phase behaviour and interfacial properties with respect of association. The paper focuses on theoretical investigations of surface tension, density profiles, surface thickness in vapour–liquid or vapour–liquid–liquid equilibrium of mixtures of water with ethanol or 1-butanol. Results of vapour–liquid equilibrium surface tension calculations were compared with experimental data taken from the literature.In the present study, we find that for water alcohol mixtures the simultaneous correlation of both phase equilibrium and interfacial properties with the SAFT EOS in combination with the Cahn–Hilliard theory is possible. The applied theoretical framework allows not the description of the maximum in interfacial tension as function of temperature in the system water and 1-butanol.
