Effects of surface size on minimalistic stochastic models for the catalytic CO oxidation

Publikation: Beitrag in FachzeitschriftArtikelForschungPeer-Review

Autoren

  • M. Pineda
  • R. Imbihl
  • L. Schimansky-Geier

Externe Organisationen

  • IFISC Instituto de Física Interdisciplinar y Sistemas Complejos (CSIC-UIB)
  • Humboldt-Universität zu Berlin (HU Berlin)
Forschungs-netzwerk anzeigen

Details

OriginalspracheEnglisch
Seiten (von - bis)1178-1188
Seitenumfang11
FachzeitschriftPhysica A: Statistical Mechanics and its Applications
Jahrgang389
Ausgabenummer6
Frühes Online-Datum17 Nov. 2009
PublikationsstatusVeröffentlicht - 15 März 2010

Abstract

The impact of surface size on two minimalistic models for the bistable CO oxidation is analytically studied. A simple model for the catalytic CO oxidation on nanoscale surfaces is analyzed by the chemical master equation. The analytical results predict a shift of the bistable region and cusp point in the global bifurcation diagram as a function of surface size. A reaction-diffusion stochastic model consisting of a collection of reactive subdomains locally coupled by CO diffusion is also considered. A local description of fluctuations can be obtained after applying a Weiss-type mean-field approximation. This approximation predicts, for infinitely many subdomains, a break of ergodicity and a bifurcation behavior like in first-order phase transitions as a function of surface size and coupling parameter. Analytical results are compared with Gillespie-type Monte Carlo simulations.

ASJC Scopus Sachgebiete

Zitieren

Effects of surface size on minimalistic stochastic models for the catalytic CO oxidation. / Pineda, M.; Imbihl, R.; Schimansky-Geier, L.
in: Physica A: Statistical Mechanics and its Applications, Jahrgang 389, Nr. 6, 15.03.2010, S. 1178-1188.

Publikation: Beitrag in FachzeitschriftArtikelForschungPeer-Review

Pineda M, Imbihl R, Schimansky-Geier L. Effects of surface size on minimalistic stochastic models for the catalytic CO oxidation. Physica A: Statistical Mechanics and its Applications. 2010 Mär 15;389(6):1178-1188. Epub 2009 Nov 17. doi: 10.1016/j.physa.2009.11.024
Pineda, M. ; Imbihl, R. ; Schimansky-Geier, L. / Effects of surface size on minimalistic stochastic models for the catalytic CO oxidation. in: Physica A: Statistical Mechanics and its Applications. 2010 ; Jahrgang 389, Nr. 6. S. 1178-1188.
Download
@article{3eec729959c64e52a23a28ed9d709d81,
title = "Effects of surface size on minimalistic stochastic models for the catalytic CO oxidation",
abstract = "The impact of surface size on two minimalistic models for the bistable CO oxidation is analytically studied. A simple model for the catalytic CO oxidation on nanoscale surfaces is analyzed by the chemical master equation. The analytical results predict a shift of the bistable region and cusp point in the global bifurcation diagram as a function of surface size. A reaction-diffusion stochastic model consisting of a collection of reactive subdomains locally coupled by CO diffusion is also considered. A local description of fluctuations can be obtained after applying a Weiss-type mean-field approximation. This approximation predicts, for infinitely many subdomains, a break of ergodicity and a bifurcation behavior like in first-order phase transitions as a function of surface size and coupling parameter. Analytical results are compared with Gillespie-type Monte Carlo simulations.",
keywords = "CO oxidation, Master equation, Monte Carlo simulations",
author = "M. Pineda and R. Imbihl and L. Schimansky-Geier",
note = "Funding Information: M.P acknowledges the financial support of project FIS2007-60327 from MICINN (Spain) and FEDER (EU). LSG acknowledges support by DFG through Sfb555.",
year = "2010",
month = mar,
day = "15",
doi = "10.1016/j.physa.2009.11.024",
language = "English",
volume = "389",
pages = "1178--1188",
journal = "Physica A: Statistical Mechanics and its Applications",
issn = "0378-4371",
publisher = "Elsevier",
number = "6",

}

Download

TY - JOUR

T1 - Effects of surface size on minimalistic stochastic models for the catalytic CO oxidation

AU - Pineda, M.

AU - Imbihl, R.

AU - Schimansky-Geier, L.

N1 - Funding Information: M.P acknowledges the financial support of project FIS2007-60327 from MICINN (Spain) and FEDER (EU). LSG acknowledges support by DFG through Sfb555.

PY - 2010/3/15

Y1 - 2010/3/15

N2 - The impact of surface size on two minimalistic models for the bistable CO oxidation is analytically studied. A simple model for the catalytic CO oxidation on nanoscale surfaces is analyzed by the chemical master equation. The analytical results predict a shift of the bistable region and cusp point in the global bifurcation diagram as a function of surface size. A reaction-diffusion stochastic model consisting of a collection of reactive subdomains locally coupled by CO diffusion is also considered. A local description of fluctuations can be obtained after applying a Weiss-type mean-field approximation. This approximation predicts, for infinitely many subdomains, a break of ergodicity and a bifurcation behavior like in first-order phase transitions as a function of surface size and coupling parameter. Analytical results are compared with Gillespie-type Monte Carlo simulations.

AB - The impact of surface size on two minimalistic models for the bistable CO oxidation is analytically studied. A simple model for the catalytic CO oxidation on nanoscale surfaces is analyzed by the chemical master equation. The analytical results predict a shift of the bistable region and cusp point in the global bifurcation diagram as a function of surface size. A reaction-diffusion stochastic model consisting of a collection of reactive subdomains locally coupled by CO diffusion is also considered. A local description of fluctuations can be obtained after applying a Weiss-type mean-field approximation. This approximation predicts, for infinitely many subdomains, a break of ergodicity and a bifurcation behavior like in first-order phase transitions as a function of surface size and coupling parameter. Analytical results are compared with Gillespie-type Monte Carlo simulations.

KW - CO oxidation

KW - Master equation

KW - Monte Carlo simulations

UR - http://www.scopus.com/inward/record.url?scp=72549105118&partnerID=8YFLogxK

U2 - 10.1016/j.physa.2009.11.024

DO - 10.1016/j.physa.2009.11.024

M3 - Article

AN - SCOPUS:72549105118

VL - 389

SP - 1178

EP - 1188

JO - Physica A: Statistical Mechanics and its Applications

JF - Physica A: Statistical Mechanics and its Applications

SN - 0378-4371

IS - 6

ER -