Charged Species Concentration in Combusting Mixtures Using Equilibrium Chemistry

Ionization in flames is of interest in the design and development of modern combustion devices. The identity and concentration of various charged species in reacting mixtures can play an important role in the diagnostics and control of such devices. Simplified chemistry computations that provide goo...

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Main Author: S. M. Aithal
Format: Article
Language:English
Published: Wiley 2018-01-01
Series:Journal of Combustion
Online Access:http://dx.doi.org/10.1155/2018/9047698
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author S. M. Aithal
author_facet S. M. Aithal
author_sort S. M. Aithal
collection DOAJ
description Ionization in flames is of interest in the design and development of modern combustion devices. The identity and concentration of various charged species in reacting mixtures can play an important role in the diagnostics and control of such devices. Simplified chemistry computations that provide good estimates of ionic species in complex flow-fields can be used to model turbulent reacting flows in various combustion devices, greatly reducing the required computational resources for design and development studies. A critical assessment of the use of the equilibrium chemistry method to compute charged species concentration in combusting mixtures under various temperatures, pressures, and thermal disequilibrium conditions is presented. The use of equilibrium chemistry to compute charged species concentrations in propane-air mixtures performed by Calcote and King has been extended. A more accurate computational methodology that includes the effect of negative ions, chemi-ions (H3O+ and CHO+), and thermal nonequilibrium was investigated to evaluate the suitability of equilibrium computations for estimating charged species concentrations in reacting mixtures. The results show that equilibrium computations which include the effects of H3O+ and elevated electron temperatures can indeed explain the levels of ion concentrations observed in laboratory flame experiments under lean and near-stoichiometric conditions. Furthermore, under engine-like conditions at higher temperatures and pressures, equilibrium computations can be used to obtain useful estimates of charged species concentrations in modern combustion devices.
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2090-1976
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spelling doaj-art-28e157b9b4f84bb0868752dfbf3d427d2025-08-20T02:03:52ZengWileyJournal of Combustion2090-19682090-19762018-01-01201810.1155/2018/90476989047698Charged Species Concentration in Combusting Mixtures Using Equilibrium ChemistryS. M. Aithal0Argonne National Laboratory, 9700 S. Cass Ave., Lemont, IL 60439, USAIonization in flames is of interest in the design and development of modern combustion devices. The identity and concentration of various charged species in reacting mixtures can play an important role in the diagnostics and control of such devices. Simplified chemistry computations that provide good estimates of ionic species in complex flow-fields can be used to model turbulent reacting flows in various combustion devices, greatly reducing the required computational resources for design and development studies. A critical assessment of the use of the equilibrium chemistry method to compute charged species concentration in combusting mixtures under various temperatures, pressures, and thermal disequilibrium conditions is presented. The use of equilibrium chemistry to compute charged species concentrations in propane-air mixtures performed by Calcote and King has been extended. A more accurate computational methodology that includes the effect of negative ions, chemi-ions (H3O+ and CHO+), and thermal nonequilibrium was investigated to evaluate the suitability of equilibrium computations for estimating charged species concentrations in reacting mixtures. The results show that equilibrium computations which include the effects of H3O+ and elevated electron temperatures can indeed explain the levels of ion concentrations observed in laboratory flame experiments under lean and near-stoichiometric conditions. Furthermore, under engine-like conditions at higher temperatures and pressures, equilibrium computations can be used to obtain useful estimates of charged species concentrations in modern combustion devices.http://dx.doi.org/10.1155/2018/9047698
spellingShingle S. M. Aithal
Charged Species Concentration in Combusting Mixtures Using Equilibrium Chemistry
Journal of Combustion
title Charged Species Concentration in Combusting Mixtures Using Equilibrium Chemistry
title_full Charged Species Concentration in Combusting Mixtures Using Equilibrium Chemistry
title_fullStr Charged Species Concentration in Combusting Mixtures Using Equilibrium Chemistry
title_full_unstemmed Charged Species Concentration in Combusting Mixtures Using Equilibrium Chemistry
title_short Charged Species Concentration in Combusting Mixtures Using Equilibrium Chemistry
title_sort charged species concentration in combusting mixtures using equilibrium chemistry
url http://dx.doi.org/10.1155/2018/9047698
work_keys_str_mv AT smaithal chargedspeciesconcentrationincombustingmixturesusingequilibriumchemistry