Conditional moment closure for chemical reactions in laminar chaotic flows

We implement conditional moment closure (CMC) for simulation of chemical reactions in laminar chaotic flows. The CMC approach predicts the expected concentration of reactive species, conditional upon the concentration of a corresponding nonreactive scalar. Closure is obtained by neglecting the diffe...

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Main Authors: Vikhansky, A., Cox, Stephen M.
Format: Article
Published: AIChE 2007
Subjects:
Online Access:https://eprints.nottingham.ac.uk/498/
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author Vikhansky, A.
Cox, Stephen M.
author_facet Vikhansky, A.
Cox, Stephen M.
author_sort Vikhansky, A.
building Nottingham Research Data Repository
collection Online Access
description We implement conditional moment closure (CMC) for simulation of chemical reactions in laminar chaotic flows. The CMC approach predicts the expected concentration of reactive species, conditional upon the concentration of a corresponding nonreactive scalar. Closure is obtained by neglecting the difference between the local concentration of the reactive scalar and its conditional average. We first use a Monte Carlo method to calculate the evolution of the moments of a conserved scalar; we then reconstruct the corresponding probability density function and dissipation rate. Finally, the concentrations of the reactive scalars are determined. The results are compared (and show excellent agreement) with full numerical simulations of the reaction processes in a chaotic laminar flow. This is a preprint of an article published in AlChE Journal copyright (2007) American Institute of Chemical Engineers: http://www3.interscience.wiley.com/
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spelling nottingham-4982020-05-04T20:28:35Z https://eprints.nottingham.ac.uk/498/ Conditional moment closure for chemical reactions in laminar chaotic flows Vikhansky, A. Cox, Stephen M. We implement conditional moment closure (CMC) for simulation of chemical reactions in laminar chaotic flows. The CMC approach predicts the expected concentration of reactive species, conditional upon the concentration of a corresponding nonreactive scalar. Closure is obtained by neglecting the difference between the local concentration of the reactive scalar and its conditional average. We first use a Monte Carlo method to calculate the evolution of the moments of a conserved scalar; we then reconstruct the corresponding probability density function and dissipation rate. Finally, the concentrations of the reactive scalars are determined. The results are compared (and show excellent agreement) with full numerical simulations of the reaction processes in a chaotic laminar flow. This is a preprint of an article published in AlChE Journal copyright (2007) American Institute of Chemical Engineers: http://www3.interscience.wiley.com/ AIChE 2007-01 Article PeerReviewed Vikhansky, A. and Cox, Stephen M. (2007) Conditional moment closure for chemical reactions in laminar chaotic flows. AIChE Journal, 53 (1). pp. 19-27. conditional moment closure chaotic advection sine flow competitive-consecutive reaction
spellingShingle conditional moment closure
chaotic advection
sine flow
competitive-consecutive reaction
Vikhansky, A.
Cox, Stephen M.
Conditional moment closure for chemical reactions in laminar chaotic flows
title Conditional moment closure for chemical reactions in laminar chaotic flows
title_full Conditional moment closure for chemical reactions in laminar chaotic flows
title_fullStr Conditional moment closure for chemical reactions in laminar chaotic flows
title_full_unstemmed Conditional moment closure for chemical reactions in laminar chaotic flows
title_short Conditional moment closure for chemical reactions in laminar chaotic flows
title_sort conditional moment closure for chemical reactions in laminar chaotic flows
topic conditional moment closure
chaotic advection
sine flow
competitive-consecutive reaction
url https://eprints.nottingham.ac.uk/498/