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Phase Transitions Affected by Interconversion and Applications to Three Atomistic Models

ORAL

Abstract

We present a general description of phase separation driven by spinodal decomposition in a binary fluid with molecular interconversion of the components. We show that without a "source'' of interconversion the system always reaches macroscopic phase separation with the domain growth enhanced by interconversion (slow phase amplification). Addition of a source of interconversion drives the system away from equilibrium and creates the possibility for arrested phase separation - the existence of non-growing (steady-state) mesoscopic phase domains. We apply the theory to three different atomistic models: the model of Glotzer et al., where interconversion is provided only by a reaction source independent from phase separation; the model of Buldyrev et al., where the presence of an external source can cause arrested phase separation or phase amplification; and the model of Uralcan et al., where an internal source originates from unbalanced intermolecular forces. The theory is in agreement with the results of simulations performed for these models.

Presenters

  • Thomas Longo

    University of Maryland, College Park

Authors

  • Thomas Longo

    University of Maryland, College Park

  • Mikhail A Anisimov

    University of Maryland, College Park