화학공학소재연구정보센터
Journal of Physical Chemistry B, Vol.115, No.16, 4654-4661, 2011
Modeling the Interfacial Tension in Oil-Water-Nonionic Surfactant Mixtures Using Dissipative Particle Dynamics and Self-Consistent Field Theory
We use two mesoscale simulation methods, dissipative particle dynamics (DPD) and self-consistent field theory (SCFT), to model interfacial tension in ternary oil/water/surfactant mixtures. For model systems where the oil is dodecane and the surfactant is a linear alkyl ethoxylate,;the two methods show a good semiquantitative agreement among themselves, and with experimental :data. We further. discuss the advantages and limitations of the two methods and their possible use for surfactant screening in specific industrial applications.