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Phys. Rev. E 71, 016213 (2005) [5 pages]

Damped oscillation in the NO+CO∕Pt(100) reaction system

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Da-yin Hua* and Jin-jun Liu
Physics Department, Ningbo University, Ningbo 315211, China

Received 2 June 2004; revised 7 September 2004; published 13 January 2005

Considering the influence of the surface defects formed in the surface restructuring phase transition in the CO+NO∕Pt(100) reaction system, we propose a lattice gas model to investigate the damped oscillation in the high-temperature oscillatory regime by means of a Monte Carlo simulation. The simulation results show that the persistent oscillation can change into a damped one when the fraction of the defects increases. The production rate of CO2 is near to the maximum value when the oscillation is damped to the end. Furthermore, it is found, in the early stage of the oscillation, that the NO decomposition mainly occurs in the 1×1 phase and the hex phase is inactive for the reaction. However, as the reaction proceeds, defects are gradually formed in the 1×1⇌ hex phase transition, the hex phase becomes active and dominative for the NO decomposition, and then the oscillation becomes damping. The simulation results give an explanation for some previous experimental phenomena.

© 2005 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevE.71.016213
DOI:
10.1103/PhysRevE.71.016213
PACS:
05.45.−a, 05.50.+q, 68.35.Rh

*Author to whom correspondence should be addressed.