• Medientyp: E-Book; Bericht; Sonstige Veröffentlichung
  • Titel: Modeling of chemical reaction systems with detailed balance using gradient structures
  • Beteiligte: Maas, Jan [VerfasserIn]; Mielke, Alexander [VerfasserIn]
  • Erschienen: Weierstrass Institute for Applied Analysis and Stochastics publication server, 2020
  • Sprache: Englisch
  • DOI: https://doi.org/10.20347/WIAS.PREPRINT.2712
  • Schlagwörter: 37L45 ; 34E13 ; article ; 35Q84 ; Reaction-rate equation -- chemical master equation -- Fokker-Planck equation -- chemical Langevin dynamics -- detailed-balance condition -- relative entropy -- dissipation potentials -- gradient structures -- many-particle limit ; 60J28
  • Entstehung:
  • Anmerkungen: Diese Datenquelle enthält auch Bestandsnachweise, die nicht zu einem Volltext führen.
  • Beschreibung: We consider various modeling levels for spatially homogeneous chemical reaction systems, namely the chemical master equation, the chemical Langevin dynamics, and the reaction-rate equation. Throughout we restrict our study to the case where the microscopic system satisfies the detailed-balance condition. The latter allows us to enrich the systems with a gradient structure, i.e. the evolution is given by a gradient-flow equation. We present the arising links between the associated gradient structures that are driven by the relative entropy of the detailed-balance steady state. The limit of large volumes is studied in the sense of evolutionary Γ-convergence of gradient flows. Moreover, we use the gradient structures to derive hybrid models for coupling different modeling levels.