Kinetic Mechanism Reduction Using Genetic Algorithms, Case Study on H2/O2 Reaction

For large and complex reacting systems, computational efficiency becomes a critical issue in process simulation, optimization and model-based control. Mechanism simplification is often a necessity to improve computational speed. We present a novel approach to simplification of reaction networks that...

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Main Authors: Hossein Abedini, Mahmoud Reza Pishvaie, Ramin Bozorgmehry Boozarjomehry
Format: Article
Language:English
Published: Iranian Institute of Research and Development in Chemical Industries (IRDCI)-ACECR 2007-09-01
Series:Iranian Journal of Chemistry & Chemical Engineering
Subjects:
Online Access:http://www.ijcce.ac.ir/article_7622_058ee3764a38358794afdde05d518a48.pdf
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author Hossein Abedini
Mahmoud Reza Pishvaie
Ramin Bozorgmehry Boozarjomehry
author_facet Hossein Abedini
Mahmoud Reza Pishvaie
Ramin Bozorgmehry Boozarjomehry
author_sort Hossein Abedini
collection DOAJ
description For large and complex reacting systems, computational efficiency becomes a critical issue in process simulation, optimization and model-based control. Mechanism simplification is often a necessity to improve computational speed. We present a novel approach to simplification of reaction networks that formulates the model reduction problem as an optimization problem and solves it using genetic algorithm (GA).The aim of simplification kinetics modeling is to derive the simplest reaction system, which retains the essential features of the full system. Numerical results for H2/O2 combustion reaction mechanism illustrate the potential and proficiency of this approach.
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spelling doaj.art-a541de0af8ec441f8d54a657dca5bea52022-12-22T01:15:58ZengIranian Institute of Research and Development in Chemical Industries (IRDCI)-ACECRIranian Journal of Chemistry & Chemical Engineering1021-99861021-99862007-09-01263197622Kinetic Mechanism Reduction Using Genetic Algorithms, Case Study on H2/O2 ReactionHossein Abedini0Mahmoud Reza Pishvaie1Ramin Bozorgmehry Boozarjomehry2Department of Chemical and Petroleum Engineering, Sharif University of Technology, P.O. Box 11365-9654 Tehran, I.R. IRANDepartment of Chemical and Petroleum Engineering, Sharif University of Technology, P.O. Box 11365-9654 Tehran, I.R. IRANDepartment of Chemical and Petroleum Engineering, Sharif University of Technology, P.O. Box 11365-9654 Tehran, I.R. IRANFor large and complex reacting systems, computational efficiency becomes a critical issue in process simulation, optimization and model-based control. Mechanism simplification is often a necessity to improve computational speed. We present a novel approach to simplification of reaction networks that formulates the model reduction problem as an optimization problem and solves it using genetic algorithm (GA).The aim of simplification kinetics modeling is to derive the simplest reaction system, which retains the essential features of the full system. Numerical results for H2/O2 combustion reaction mechanism illustrate the potential and proficiency of this approach.http://www.ijcce.ac.ir/article_7622_058ee3764a38358794afdde05d518a48.pdfkinetic reductionoptimizationgenetic algorithmsimulationreaction networks
spellingShingle Hossein Abedini
Mahmoud Reza Pishvaie
Ramin Bozorgmehry Boozarjomehry
Kinetic Mechanism Reduction Using Genetic Algorithms, Case Study on H2/O2 Reaction
Iranian Journal of Chemistry & Chemical Engineering
kinetic reduction
optimization
genetic algorithm
simulation
reaction networks
title Kinetic Mechanism Reduction Using Genetic Algorithms, Case Study on H2/O2 Reaction
title_full Kinetic Mechanism Reduction Using Genetic Algorithms, Case Study on H2/O2 Reaction
title_fullStr Kinetic Mechanism Reduction Using Genetic Algorithms, Case Study on H2/O2 Reaction
title_full_unstemmed Kinetic Mechanism Reduction Using Genetic Algorithms, Case Study on H2/O2 Reaction
title_short Kinetic Mechanism Reduction Using Genetic Algorithms, Case Study on H2/O2 Reaction
title_sort kinetic mechanism reduction using genetic algorithms case study on h2 o2 reaction
topic kinetic reduction
optimization
genetic algorithm
simulation
reaction networks
url http://www.ijcce.ac.ir/article_7622_058ee3764a38358794afdde05d518a48.pdf
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AT raminbozorgmehryboozarjomehry kineticmechanismreductionusinggeneticalgorithmscasestudyonh2o2reaction