Binary fluid mixtures of 1:1 concentration can demix in a phase transition of first order or of second order. We analyze the two scenarios in density-concentration space and relate them to the structure of the line at which the demixing coexistence surface cuts the liquid-vapor coexistence surface. These scenarios help us to decide between first and second order for a model of a symmetric Lennard-Jones mixture. An optimized reference hypernetted chain integral equation method is employed for calculating the correlation functions and from there the pressure and chemical potentials. We conclude that demixing of a 1:1 mixture is of first order in the whole range of parameters that we have investigated. We did not find a critical point in the 1:1 concentration plane.
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Univ So Calif, Dept Psychol, Grad Program Neurosci, Los Angeles, CA 90089 USAUniv So Calif, Dept Psychol, Grad Program Neurosci, Los Angeles, CA 90089 USA
Tjan, B. S.
Nandy, A. S.
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Univ So Calif, Dept Psychol, Grad Program Neurosci, Los Angeles, CA 90089 USAUniv So Calif, Dept Psychol, Grad Program Neurosci, Los Angeles, CA 90089 USA
机构:
UPM, Escuela Tecn Super Arquitectura, Dept Matemat Aplicada, Avda Juan de Herrera 4, Madrid 28040, SpainUPM, Escuela Tecn Super Arquitectura, Dept Matemat Aplicada, Avda Juan de Herrera 4, Madrid 28040, Spain
Rosado Maria, E.
Munoz Masque, J.
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CSIC, Inst Tecnol Fis & Informac, C Serrano 144, E-28006 Madrid, SpainUPM, Escuela Tecn Super Arquitectura, Dept Matemat Aplicada, Avda Juan de Herrera 4, Madrid 28040, Spain