Discontinuous non-equilibrium phase transition in a threshold Schloegl model for autocatalysis: Generic two-phase coexistence and metastability
- 1. Department of Mathematics, Iowa State University, Ames, Iowa 50011 (United States)
- 2. Ames Laboratory–USDOE, Iowa State University, Ames, Iowa 50011 (United States)
- 3. Department of Physics and Astronomy, Iowa State University, Ames, Iowa 50011 (United States)
Description
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
Additional details
Identifiers
- DOI
- 10.1063/1.4918908;
Publishing Information
- Journal Title
- Journal of Chemical Physics
- Journal Volume
- 142
- Journal Issue
- 16
- Journal Page Range
- p. 164105-164105.12
- ISSN
- 0021-9606
- CODEN
- JCPSA6
INIS
- Country of Publication
- United States
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 46121589
- Subject category
- S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY;
- Descriptors DEI
- ANNIHILATION; EQUILIBRIUM; MEAN-FIELD THEORY; PARTICLES; PHASE RULE; PHASE STABILITY; PHASE STUDIES; PHASE TRANSFORMATIONS; TETRAGONAL LATTICES; THERMODYNAMICS; VACUUM STATES
- Descriptors DEC
- CRYSTAL LATTICES; CRYSTAL STRUCTURE; INTERACTIONS; PARTICLE INTERACTIONS; STABILITY; THREE-DIMENSIONAL LATTICES
Optional Information
- Notes
- (c) 2015 AIP Publishing LLC