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Solid-liquid coexistence of polydisperse fluids via simulation
2009
Journal of Chemical Physics
We describe a simulation method for the accurate study of the equilibrium freezing properties of polydisperse fluids under the experimentally relevant condition of fixed polydispersity. The approach is based on the phase switch Monte Carlo method of Wilding and Bruce [Phys. Rev. Lett. 85, 5138 (2000)]. This we have generalized to deal with particle size polydispersity by incorporating updates which alter the diameter σ of a particle, under the control of a distribution of chemical potential
doi:10.1063/1.3081141
pmid:19292519
fatcat:s5o2kbi5hjao5lzsb23yywasbi