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Article
Discontinuous non-equilibrium phase transition in a threshold Schloegl model for autocatalysis: Generic two-phase coexistence and metastability
Journal of Chemical Physics
  • Chi-Jen Wang, Iowa State University
  • Da-Jiang Liu, Iowa State University
  • James W. Evans, Iowa State University
Document Type
Article
Publication Version
Published Version
Publication Date
4-1-2015
DOI
10.1063/1.4918908
Abstract
Threshold versions of Schloegl's model on a lattice, which involve autocatalytic creation and spontaneous annihilation of particles, can provide a simple prototype for discontinuous non-equilibrium phase transitions. These models are equivalent to so-called threshold contact processes. A discontinuous transition between populated and vacuum states can occur selecting a threshold of N ≥ 2 for the minimum number, N, of neighboring particles enabling autocatalytic creation at an empty site. Fundamental open questions remain given the lack of a thermodynamic framework for analysis. For a square lattice with N = 2, we show that phase coexistence occurs not at a unique value but for a finite range of particle annihilation rate (the natural control parameter). This generic two-phase coexistence also persists when perturbing the model to allow spontaneous particle creation. Such behavior contrasts both the Gibbs phase rule for thermodynamic systems and also previous analysis for this model. We find metastability near the transition corresponding to a non-zero effective line tension, also contrasting previously suggested critical behavior. Mean-field type analysis, extended to treat spatially heterogeneous states, further elucidates model behavior.
Comments

The following article appeared in Journal of Chemical Physics 142, 16 (2015): 164105 and may be found at doi: 10.1063/1.4918908.

Rights
Copyright 2015 American Institute of Physics. This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics.
Copyright Owner
American Institute of Physics
Language
en
File Format
application/pdf
Citation Information
Chi-Jen Wang, Da-Jiang Liu and James W. Evans. "Discontinuous non-equilibrium phase transition in a threshold Schloegl model for autocatalysis: Generic two-phase coexistence and metastability" Journal of Chemical Physics Vol. 142 Iss. 16 (2015) p. 164105-1 - 164105-12
Available at: http://works.bepress.com/james-evans/41/