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1.
J Chem Phys ; 120(14): 6423-9, 2004 Apr 08.
Article in English | MEDLINE | ID: mdl-15267531

ABSTRACT

We study global decay of the bimolecular reaction A+B-->P as c(t) approximately t(-alpha) in a nonlinear transitional flow. A relationship is established between the decay exponent alpha, and a modified Kolmogorov-Sinai entropy, hr. We find that for dynamic conditions which induce relatively strong mixing, the decay exponent is alpha is proportional to ln psi(-Bhr) with B being a characteristic reactive mix-down time for the system, and psi is a space-time scaling parameter. Dynamic conditions which imply weak mixing lead to a degenerate dependence of alpha on hr. The proposed relationship between alpha on hr should be a useful link between the dynamical evolution of the flow field and reaction kinetics in vortex dominated flows.


Subject(s)
Entropy , Kinetics , Nonlinear Dynamics , Mathematics , Models, Chemical , Motion
2.
Phys Rev Lett ; 90(2): 028303, 2003 Jan 17.
Article in English | MEDLINE | ID: mdl-12570585

ABSTRACT

We propose a new scaling law for global kinetics of the stoichiometric reaction A+B-->P in unsteady, transitional flows. We find in the nonlinear flow regime the decay as approximately t(-alpha) where alpha is related to a space-time scaling parameter psi as alpha proportional, variant psi(m), for the considered parameter range m=0.067. In the linear flow regime, we find that the maximum is alpha approximately 2/3 for psi approximately 1. The proposed scaling law should be useful for linking dynamical subgrid processes with reaction kinetics in a variety of transitional flow systems.


Subject(s)
Biochemistry/methods , Models, Chemical , Kinetics
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