Litcius/Paper detail

Recent advances in particle-based simulation of surfactants

Tseden Taddese, R. L. Anderson, David J. Bray, Patrick B. Warren

2020Current Opinion in Colloid & Interface Science52 citationsDOIOpen Access PDF

Abstract

We review the recent literature on particle-based simulation of surfactants, focusing on key methodological developments in the areas of surfactant self-assembly, micelle formation, micelle kinetics, the properties of worm-like micelles, interfacial adsorption and surface tension. We pay particular attention to dissipative particle dynamics where a considerable amount of work has been performed recently to improve parametrisation and apply the method quantitatively to surfactant systems. We discuss highlights and outstanding challenges and make suggestions for priority areas for future research directions.

Topics & Concepts

Dissipative particle dynamicsMicellePulmonary surfactantSurface tensionParticle (ecology)AdsorptionCritical micelle concentrationDissipative systemNanotechnologyMaterials scienceChemical engineeringChemistryPhysicsThermodynamicsEngineeringPhysical chemistryGeologyPolymerComposite materialAqueous solutionOceanographySurfactants and Colloidal SystemsAdvanced Polymer Synthesis and CharacterizationBlock Copolymer Self-Assembly