16 results on '"Detailed chemical kinetic"'
Search Results
2. Quasi-Dimensional Modeling of a CNG Fueled HCCI Engine Combustion Using Detailed Chemical Kinetic
- Author
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Younes Bakhshan and A.H Shadaei
- Subjects
HCCI ,quasi dimensional ,detailed chemical kinetic ,CNG ,simulation ,k–ε ,Mechanical engineering and machinery ,TJ1-1570 - Abstract
In this study, an in-house quasi dimensional code has been developed which simulates the intake, compression, combustion, expansion and exhaust strokes of a homogeneous charge compression ignition (HCCI) engine. The compressed natural gas (CNG) has been used as fuel. A detailed chemical kinetic scheme constituting of 310 and 1701 elementary equations developed by Bakhshan et al. has been applied for combustion modeling and heat release calculations. The zero-dimensional k-ε turbulence model has been used for calculation of heat transfer. The output results are the performance and pollutants emission and combustion characteristics in HCCI engines. Parametric studies have been conducted to discussing the effects of various parameters on performance and pollutants emission of these engines.
- Published
- 2013
3. Quasi-Dimensional Modeling of a CNG Fueled HCCI Engine Combustion Using Detailed Chemical Kinetic.
- Author
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Bakhshan, Y. and Shadaei, A. H.
- Subjects
DIESEL motors ,COMPRESSED natural gas ,CHEMICAL kinetics ,HEAT transfer ,AUTOMOBILE engine combustion - Abstract
In this study, an in-house quasi dimensional code has been developed which simulates the intake, compression, combustion, expansion and exhaust strokes of a homogeneous charge compression ignition (HCCI) engine. The compressed natural gas (CNG) has been used as fuel. A detailed chemical kinetic scheme constituting of 310 and 1701 elementary equations developed by Bakhshan et al. has been applied for combustion modeling'andheat release calculations. The zero-dimensional k-ϵ turbulence model has been used for calculation of heat transfer. The output results are the performance and pollutants emission and combustion characteristics in HCCI engines. Parametric studies have been conducted to discussing the effects of various parameters on performance and pollutants emission of these engines. [ABSTRACT FROM AUTHOR]
- Published
- 2013
- Full Text
- View/download PDF
4. Measurement and simulation of pollutant emissions from marine diesel combustion engine and their reduction by water injection
- Author
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Larbi, Nader and Bessrour, Jamel
- Subjects
- *
CHEMICAL kinetics , *DIESEL motor combustion , *NUMERICAL analysis , *POLLUTANTS , *MARINE diesel motors , *DIESEL motor exhaust gas , *SIMULATION methods & models - Abstract
Abstract: Taking into account the complexity and cost involved to conduct an experimental investment, the recourse to a tool of simulation, which in turn entails access to information by measurement, offers an effective and fast alternative to deal with the problem of pollutant emissions from internal combustion engines. An analytical model based on detailed chemical kinetics employed to calculate the pollutant emissions of a marine diesel engine gave results, in general, satisfactory compared to experimentally measured results. Especially the NO emission contents are found higher than the standards limiting values set out by the International Maritime Organisation (IMO). Thus, this study is undertaken in order to reduce as much as possible these emissions. The reduction of pollutant emissions is apprehended with water injection. [Copyright &y& Elsevier]
- Published
- 2010
- Full Text
- View/download PDF
5. Measurement and simulation of pollutant emissions from marine diesel combustion engine and their reduction by exhaust gas recirculation.
- Author
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Larbi, Nader and Bessrour, Jamel
- Abstract
Taking into account the complexity and cost of a direct experimental approach, the recourse to simulation, which can also predict inaccessible information by measurement, offers an effective and fast alternative to apprehend the problem of pollutant emissions from internal combustion engines. An analytical model based on detailed chemical kinetics employed to calculate the pollutant emissions of a marine Diesel engine in general gave satisfactory results compared to experimentally measured results. Especially, the nitric oxide (NO) emission values were found to be higher than the limiting values tolerated by the International Maritime Organization (IMO). Thus, this study was undertaken to reduce to the maximum these emissions. The reduction of pollutant emissions is apprehended with exhaust gas recirculation (EGR). [ABSTRACT FROM AUTHOR]
- Published
- 2008
- Full Text
- View/download PDF
6. SIMULATION OF POLLUTANT EMISSIONS FROM A GAS-TURBINE COMBUSTOR.
- Author
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Mohamed, Hamdi, Ticha, Hmaid Ben, and Mohamed, Sassi
- Subjects
TURBINES ,EMISSIONS (Air pollution) ,CHEMICAL kinetics ,NITROGEN oxides ,CARBON monoxide - Abstract
In the present study, an emission model using a detailed chemical kinetic scheme is used to provide the trends of formation and/or consumption of nitrogen oxides (NO
x ), carbon monoxide (CO), and unburned hydrocarbons (UHCs) in various zones of a conventional gas-turbine combustor. This model consists of a number of chemical reactors in series and/or in parallel that simulate various regions of the combustor. The success of this type of approach relies on the proper selection of the flow model and the reactor arrangement, in addition to the inclusion of means to account for spray evaporation and mixing in the combustion zone. The computational results show that NOx emissions are higher for longer residence times in the combustor, whereas CO and UHC are, on the contrary, lower. Because these last two are normal intermediates in hydrocarbon combustion, the problem is one of consumption rather than production. Their emissions increase with lower residence times, which reduces their chances to be oxidized. [ABSTRACT FROM AUTHOR]- Published
- 2004
- Full Text
- View/download PDF
7. Numerical investigation of laminar cross-flow non-premixed flames in the presence of a bluff-body
- Author
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Puthiyaparambath Kozhumal Shijin, Vasudevan Raghavan, S. Soma Sundaram, and Viswanathan Babu
- Subjects
Work (thermodynamics) ,Laminar flame speed ,Bluff body ,Cross flows ,Detailed chemical kinetic ,Non-premixed flame ,Numerical investigations ,Vorticity dynamics ,General Chemical Engineering ,Flow (psychology) ,General Physics and Astronomy ,Energy Engineering and Power Technology ,Thermodynamics ,Laminar flow ,General Chemistry ,Stability (probability) ,Methane ,Damköhler numbers ,chemistry.chemical_compound ,Fuel Technology ,chemistry ,Modeling and Simulation ,Transient (oscillation) - Abstract
A knowledge of flame stability regimes in the presence of cylindrical bluff-bodies of various dimensions is essential to design non-premixed burners. The reacting flow field in such cases is reported to be three-dimensional and unsteady. In the literature, only a few experimental investigations with limited measurements are available. Therefore, in this work, a detailed numerical study of laminar cross-flow non-premixed methane�air flames in the presence of a square cylinder is presented. The flow, temperature, species and reaction fields have been predicted using a comprehensive transient three-dimensional reacting flow model with detailed chemical kinetics and variable thermo-physical properties, in order to get a good insight into the flame stabilisation phenomena. Further, analyses of quantities such as local equivalence ratio, cell Damk�hler number, species velocity, net consumption rate of methane, which are not easily obtained through experiments even with detailed diagnostics, have been carried out. The influence of the flow field due to varying inlet velocity of the oxidiser, in the presence of the bluff-body, on flame anchoring location has been analysed in detail. Local equivalence ratio contours obtained from non-reacting flow calculations are seen to be quite useful in analysing the mixing process and in the prediction of flame anchoring locations when the flames are not separated. Cell Damk�hler number has been calculated using cell size, species velocity of the fuel, which is a derived quantity, and the net reaction rate of the fuel. The flame zone, which is customarily inferred from the contours of temperature, CO and OH, is also shown to be predicted well by the contour line corresponding to a Damk�hler number equal to unity. The net reaction rate of CH4 and the net rates of two dominant reactions, which consume methane, show clearly the variation in the flame anchoring locations in these three cases. Further, the three-dimensionality of these flames are analysed by plotting the mean temperature contours in y�z planes. Finally, the unsteadiness in the separated flame case is analysed. � 2014, � 2014 Taylor & Francis.
- Published
- 2014
- Full Text
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8. The role of detailed chemical kinetics on CFD diesel spray ignition and combustion modelling
- Author
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Ricardo Novella, Vicent Domenech, Antonio García, and José M. Pastor
- Subjects
Chemical process ,Work (thermodynamics) ,Sandia National Laboratories ,Detailed chemistry ,Nuclear engineering ,General methodologies ,Experimental database ,Combustion ,law.invention ,Oxidation mechanisms ,law ,Range (aeronautics) ,Ignition delays ,N-Heptanes ,Open source frameworks ,Heptane ,Diesel combustion ,Spray ignition ,Ignition ,Stabilization ,Computer Science Applications ,ODE Solver ,Chemical mechanism ,Diesel spray ,Modeling and Simulation ,MAQUINAS Y MOTORES TERMICOS ,Chemical history ,Combustion modelling ,Combustion condition ,Chemistry models ,Elsevier ,Flame structure ,Computational fluid dynamics ,Degree of complexity ,Modelling and Simulation ,Detailed chemical kinetic ,Numerical investigations ,Simulation ,Constant-volume vessel ,business.industry ,Combustion characteristics ,CFD modelling ,CFD simulations ,Ignition system ,Low oxygen ,Volume (thermodynamics) ,OpenFOAM © ,Ambient conditions ,business ,Flame stabilisation - Abstract
Spray ignition and flame stabilisation in the frame of diesel-like combustion conditions combine fundamental and complex physical and chemical processes. In this work, a numerical investigation has been performed to evaluate the potential of integrating detailed chemistry into CFD calculations, in order to improve predictions and gain more insight in involved processes. This work has been carried out using the capabilities of OpenFOAM ©code, which provides an opensource framework for 3D-CFD simulations, including an ODE solver for solving chemical kinetics. As a general methodology, this study is based on simulating free n-heptane sprays injected into a constant volume vessel, corresponding to the conditions of the experimental database provided by Sandia National Laboratories. Calculations results have been compared to experiments, evaluating the effect of a wide range of ambient conditions on spray ignition and combustion characteristics. Specifically, this research checks the performance of some relevant n-heptane oxidation mechanisms found in the literature, with different degree of complexity, for modelling the chemical history of the fuel. The results of this investigation show the relative influence of chemical mechanism on spray/flame structure in terms of ignition delay and also ignition and flame stabilisation sites. The comprehensive mechanism performs generally better than more simplified chemistry models. However, its accuracy is also compromised for modelling advanced diesel-like combustion concepts based on injecting the spray into a low oxygen concentration environment. © 2010 Elsevier Ltd.
- Published
- 2011
- Full Text
- View/download PDF
9. Investigation of structures and reaction zones of methane–hydrogen laminar jet diffusion flames
- Author
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K. Alex Francis, R. Sreenivasan, and Vasudevan Raghavan
- Subjects
Hydrogen ,Renewable Energy, Sustainability and the Environment ,Diffusion ,Flame structure ,Analytical chemistry ,Detailed chemical kinetic ,Hydrogen-methane mixture ,Jet diffusion flames ,Net reaction rates ,Optically thin radiation model ,Computer simulation ,Free radicals ,Fuels ,Methane ,Mixtures ,Photography ,Reaction rates ,Energy Engineering and Power Technology ,chemistry.chemical_element ,Condensed Matter Physics ,Reaction rate ,Chemical kinetics ,chemistry.chemical_compound ,Fuel Technology ,chemistry ,Volume (thermodynamics) ,Mass fraction - Abstract
Investigations of structure and reaction zones of unconfined methane-hydrogen laminar jet diffusion flames are presented. In a lab-scale burner, experiments have been conducted using a mixture of pure methane and pure hydrogen in different volumetric proportions. Digital photographs of the flames have been captured and the radial temperature profiles at different axial locations outside the flame zone have been measured. Numerical simulations are carried out with a C2 chemical kinetics mechanism having 25 species and 121 reaction steps and an optically thin radiation sub-model. The numerical results are validated against the experimental data. Parametric studies have been carried out for a range of methane-hydrogen mixtures with volumetric proportion of hydrogen in the mixture varying from 0% to 80%. Variation of flame height, contours of temperature, mass fractions of product species and the net reaction rates of methane and hydrogen for various cases are presented and discussed in detail. Further, analysis of net reaction rates of important reactions involving methane and hydrogen with radicals such as O, H and OH are analyzed. The maximum temperature in the domain is seen to decrease for the fuel mixtures with higher hydrogen content. The overall flame length also decreases. For a fuel mixture having 40% hydrogen by volume, the net molar consumption rates of methane and hydrogen are found to be almost equal. Examination of individual reactions of fuel species with radicals shows that hydrogen is mainly consumed by its reaction with OH, whereas methane consumption is mainly through its reactions involving H as well as OH radicals. � 2011, Hydrogen Energy Publications, LLC. Published by Elsevier Ltd. All rights reserved.
- Published
- 2011
- Full Text
- View/download PDF
10. NUMERICAL STUDY OF STRUCTURES OF LAMINAR OPPOSED FLOW PREMIXED METHANE-HYDROGEN-AIR FLAMES AT LOW STRAIN RATE
- Author
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Deshpande Shrikrishna, Vasudevan Raghavan, and R. Sreenivasan
- Subjects
Premixed flame ,Materials science ,Laminar flame speed ,Flame structure ,Diffusion flame ,Laminar flow ,Mechanics ,Strain rate ,Methane ,Reaction rate ,chemistry.chemical_compound ,chemistry ,Air mixtures ,Chemical mechanism ,Detailed chemical kinetic ,Equivalence ratios ,Experimental data ,Flame zones ,Fuel mixtures ,Laminar counterflow ,Lean mixtures ,Low strain rates ,Methane-air ,Numerical investigations ,Numerical models ,Numerical studies ,Opposed flow ,Opposed flow flames ,Optically thin radiation model ,Parametric study ,Premixed ,Reaction steps ,Reaction zones ,Side streams ,Species concentration ,Submodels ,Volumetric fractions ,Combustors ,Computer simulation ,Hydrogen ,Mixtures ,Numerical methods ,Reaction rates ,General Environmental Science - Abstract
Numerical investigation of laminar counterflow premixed methane-hydrogen-air flames at a low strain rate is presented. Simulations are carried out with a numerical model incorporated with C2 chemical mechanism having 25 species and 121 reaction steps, and with an optically thin radiation submodel. The numerical model is validated using the experimental data reported in the literature in terms of temperature and species concentrations in flames from opposed flow premixed methane-air and hydrogen-air streams. Parametric studies are performed for opposed flowing methanehydrogen and air mixtures. A premixed methane-hydrogen and air with a rich mixture equivalence ratio (1.75) flows from the top duct, and one having a lean mixture equivalence ratio (0.25) flows from the bottom duct. The volumetric fraction of hydrogen in the fuel mixture has been varied from 20 to 80%. The strain rate used in the present study is kept constant at 50 s -1. Variation of velocity, temperature, species concentrations, and net reaction rates of oxygen, methane and hydrogen along the axis for various cases are presented and discussed in detail. Double flame zones are observed for all the cases. The addition of hydrogen to the rich side stream is seen to be effective in modifying the extents of both reaction zones. The reaction rate of methane is seen to be enhanced with the addition of hydrogen. � 2011 by Begell House, Inc.
- Published
- 2011
- Full Text
- View/download PDF
11. NUMERICAL INVESTIGATION OF BURNING AND EMISSION CHARACTERISTICS OF LAMINAR METHANE DIFFUSION FLAMES IN PREHEATED OXIDIZER
- Author
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Thirumalachari Sundararajan, Vasudevan Raghavan, and R. Sreenivasan
- Subjects
Emission characteristics ,model validation ,Analytical chemistry ,Combustion ,heating ,Methane-air ,Oxygen ,Methane ,Diffusion ,chemistry.chemical_compound ,laminar flow ,emission control ,Flame stability ,Submodels ,Oxidizer stream ,Particulate emissions ,Diffusion (business) ,burning ,Maximum temperature ,methane ,Coflowing ,emission inventory ,Diffusion flame ,Mechanics ,Methane diffusion ,parameterization ,Pollution ,Chemical mechanism ,Numerical results ,Stabilizing effects ,reaction kinetics ,airflow ,Parametric study ,oxidation ,Airflow ,Preheated oxidizer ,Energy Engineering and Power Technology ,chemistry.chemical_element ,carbon monoxide ,nitric oxide ,Detailed chemical kinetic ,Numerical investigations ,Coflow diffusion flames ,Stream flow ,Laminar flow ,Radiation models ,Flame height ,Hot products ,Carbon dioxide ,chemistry ,Automotive Engineering ,Coflow flame ,numerical model ,Carbon monoxide - Abstract
Numerical investigations of burning and emission characteristics of laminar methane diffusion flames in a coflowing preheated oxidizer are presented. The preheated oxidizer stream contains hot products of combustion, such as carbon dioxide and water vapor, along with oxygen and nitrogen, and is equivalent to that obtained in an exhaust gas recirculation process. Numerical simulations are carried out using a numerical model incorporated with a C2 chemical mechanism having 25 species and 121 reactions and an optically thin radiation submodel. The numerical results are validated against the experimental results for methane-air coflow flames reported in the literature. Parametric studies have been carried out by changing the temperature and composition of the coflowing oxidizer stream. The effects of these parameters on flame height, flame stability, and emission characteristics are analyzed. It is observed that the increase in the temperature of the oxidizer has a stabilizing effect on the flame, even with a lesser concentration of oxygen in the oxidizer. By investigating the stable flame cases in which a maximum temperature of around 2000 K is achieved, it can be concluded that the preheated oxidizer stream (higher temperature and reduced oxygen) helps in significant reduction of emissions such as nitric oxide and carbon monoxide. � 2010 by Begell House, Inc.
- Published
- 2010
- Full Text
- View/download PDF
12. Phenomenological modeling of combustion and NOx emissions using detailed tabulated chemistry methods in diesel engines
- Author
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Rezaei, Reza, Dinkelacker, Friedrich, Tilch, Benjamin, Delebinski, Thaddaeus, and Brauer, Maximilian
- Subjects
Diesel engine ,Light-duty diesel engines ,Diesel engines ,Heavy-duty diesel engine ,Combustion ,Exhaust gas recirculation ,Ignition ,Exhaust gases ,Kinetics ,Perfectly stirred reactor ,Transient conditions ,phenomenological modeling ,NOx emissions ,Computational effort ,reaction kinetics ,ddc:621 ,Engines ,Dewey Decimal Classification::600 | Technik::620 | Ingenieurwissenschaften und Maschinenbau::621 | Angewandte Physik ,Detailed chemical kinetic ,Engine cylinders - Abstract
Enhancing the predictive quality of engine models, while maintaining an affordable computational cost, is of great importance. In this study, a phenomenological combustion and a tabulated NOx model, focusing on efficient modeling and improvement of computational effort, is presented. The proposed approach employs physical and chemical sub-models for local processes such as injection, spray formation, ignition, combustion, and NOx formation, being based on detailed tabulated chemistry methods. The applied combustion model accounts for the turbulence-controlled as well as the chemistry-controlled combustion. The phenomenological combustion model is first assessed for passenger car application, especially with multiple pilot injections and high exhaust gas recirculation ratios for low-load operating points. The validation results are presented for representative operating conditions from a single-cylinder light-duty diesel engine and over the entire engine map of a heavy-duty diesel engine. In the second part of this study, a novel approach for accurate and very fast modeling of NO formation in combustion engines is proposed. The major focus of this study is on the development of a very fast-running NO mechanism for usage in the next generation of the engine control units. This approach is based on tabulation of a detailed chemical kinetic mechanism and is validated against the detailed chemical reaction mechanism at all engine-relevant conditions with the variation in pressure, temperature, and air-fuel ratio under stationary and ramp-type transient conditions in a perfectly stirred reactor. Using this approach, a very good match to the results from calculations with the detailed chemical mechanism is observed. Finally, the tabulated NOx kinetic model is implemented in the combustion model for in-cylinder NOx prediction and compared with the experimental engine measurement data. © 2015 Institution of Mechanical Engineers.
- Published
- 2016
13. Structure and reaction zones of hydrogen e Carbon-monoxide laminar jet diffusion flames
- Author
-
Naeem Khan and Vasudevan Raghavan
- Subjects
Premixed flame ,Jet (fluid) ,Hydrogen ,Laminar flame speed ,Renewable Energy, Sustainability and the Environment ,Chemistry ,Flame structure ,Diffusion flame ,Energy Engineering and Power Technology ,chemistry.chemical_element ,Mechanics ,Condensed Matter Physics ,Carbon ,Carbon dioxide ,Carbon monoxide ,Diffusion ,Fuels ,Mixtures ,Numerical models ,Reaction rates ,Temperature control ,Carbon dioxide decrease ,Detailed chemical kinetic ,Flame height ,Jet diffusion flame ,Laminar jet diffusion flames ,Numerical investigations ,Radial temperature profile ,Reaction rate ,Fuel Technology ,Physics::Chemical Physics ,Diffusion (business) ,Atomic physics - Abstract
In this study, experimental and numerical investigations of laminar jet diffusion flames using carbon-monoxide e hydrogen mixtures are carried out. Using a simple experimental setup, high definition direct flame photographs and shadowgraphs are captured, and radial temperature profiles at two axial locations are measured. Numerical simulations of carbon-monoxide e hydrogen jet diffusion flames have been carried out using a comprehensive computational model, along with simplified detailed chemical kinetics mechanism having 14 species and 38 reactions, and an optically thin approximation based radiation sub-model. Validation of the numerical model is carried out by comparing the measured and predicted temperature profiles, and experimental shadowgraph images with second derivative of the predicted density field. Results from the numerical simulations provide insights to the structures, species and thermal fields of flames for varying hydrogen content in the fuel mixture. It is observed that the axial extent of the maximum temperature zone tends to move towards the burner exit as the percentage of hydrogen in the fuel increases. It is also observed that the maximum mass fraction of carbon-dioxide decreases and those of OH and water vapour increase with increasing percentage of hydrogen in the fuel. Radial distributions of important species are presented for varying hydrogen content in the fuel mixture, which clearly illustrate the structure of the flame. Radial profiles of net reaction rates of major species and net rates of few important reactions are presented. As hydrogen is added, the reaction zone moves out in the radial direction, increasing the radius of the flame. Copyright � 2014, Hydrogen Energy Publications, LLC. Published by Elsevier Ltd. All rights reserved.
- Published
- 2014
14. An investigation of flame zones and burning velocities of laminar unconfined methane-oxygen premixed flames
- Author
-
Thirumalachari Sundararajan, R. Sreenivasan, and Vasudevan Raghavan
- Subjects
Laminar flame speed ,Parametric study ,General Chemical Engineering ,Axial locations ,Premixed Flame ,Visible region ,Analytical chemistry ,General Physics and Astronomy ,Energy Engineering and Power Technology ,chemistry.chemical_element ,Pure oxygen ,Mass fraction ,Fuels ,Oxygen ,Methane ,Methane consumption ,chemistry.chemical_compound ,Equivalence ratios ,Thermocouple ,Photography ,Detailed chemical kinetic ,Premixed flame ,Chemistry ,Methane-air premixed flame ,Burning velocity ,Laminar flow ,General Chemistry ,Mechanics ,Chemical mechanism ,Fuel Technology ,Carbon dioxide ,Thermocouples ,Modeling and Simulation ,Flame zones ,laminar premixed flames ,optically thin radiation model ,Combustor ,Numerical results ,Radial temperature profile ,Experiments ,Digital photographs ,Experimental investigations - Abstract
Numerical and experimental investigations of unconfined methane-oxygen laminar premixed flames are presented. In a lab-scale burner, premixed flame experiments have been conducted using pure methane and pure oxygen mixtures having different equivalence ratios. Digital photographs of the flames have been captured and the radial temperature profiles at different axial locations have been measured using a thermocouple. Numerical simulations have been carried out with a C2 chemical mechanism having 25 species and 121 reactions and with an optically thin radiation sub-model. The numerical results are validated against the experimental and numerical results for methane-air premixed flames reported in literature. Further, the numerical results are validated against the results from the present methane-oxygen flame experiments. Visible regions in digital flame photographs have been compared with OH isopleths predicted by the numerical model. Parametric studies have been carried out for a range of equivalence ratios, varying from 0.24 to 1.55. The contours of OH, temperature and mass fractions of product species such as CO, CO 2 and H 2O, are presented and discussed for various cases. By using the net methane consumption rate, an estimate of the laminar flame speed has been obtained as a function of equivalence ratio. � 2012 Taylor and Francis Group, LLC.
- Published
- 2012
15. Effect of hydrogen addition in the co-flow of a methane diffusion flame in reducing nitric oxide emissions
- Author
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S. Arun, S. Raghuram, R. Sreenivasan, and Vasudevan Raghavan
- Subjects
Hydrogen ,Numerical models ,Flow (psychology) ,Inorganic chemistry ,Energy Engineering and Power Technology ,chemistry.chemical_element ,Combustion ,Fuels ,Kinetic energy ,Methane ,Physics::Fluid Dynamics ,Diffusion ,chemistry.chemical_compound ,Diffusion Flame ,Nitric oxide emissions ,Physics::Chemical Physics ,Diffusion (business) ,Detailed chemical kinetic ,Jet (fluid) ,Renewable Energy, Sustainability and the Environment ,Diffusion flame ,Nitric oxide ,Condensed Matter Physics ,Fuel mixtures ,Radiation models ,Fuel Technology ,Chemical engineering ,chemistry - Abstract
The paper presents numerical simulations of a core methane jet diffusion flame with a fuel lean mixture (consisting of methane and hydrogen, in different proportions) in the co-flow. A comprehensive numerical model, which employs a detailed chemical kinetic mechanism with 25 species and 121 reaction steps, variable thermo-physical properties, multi-component diffusion and an optically thin radiation sub-model, has been used. The results of the numerical model are validated against the experimental data from literature. The validated model is used to study the characteristics of core methane jet diffusion flames with methane and hydrogen in the co-flow. A detailed study of various quantities such as temperature, sensible enthalpies of combustion and nitric oxide emissions is carried out, for different compositions of the fuel in the co-flow oxidizer stream. The co-flow composition which results in minimum nitric oxide emissions is examined. Copyright � 2012, Hydrogen Energy Publications, LLC. Published by Elsevier Ltd. All rights reserved.
- Published
- 2012
16. The role of detailed chemical kinetics on CFD diesel spray ignition and combustion modelling
- Author
-
Universitat Politècnica de València. Departamento de Máquinas y Motores Térmicos - Departament de Màquines i Motors Tèrmics, Novella Rosa, Ricardo, García Martínez, Antonio, Pastor Enguídanos, José Manuel, Domenech Llopis, Vicente, Universitat Politècnica de València. Departamento de Máquinas y Motores Térmicos - Departament de Màquines i Motors Tèrmics, Novella Rosa, Ricardo, García Martínez, Antonio, Pastor Enguídanos, José Manuel, and Domenech Llopis, Vicente
- Abstract
Spray ignition and flame stabilisation in the frame of diesel-like combustion conditions combine fundamental and complex physical and chemical processes. In this work, a numerical investigation has been performed to evaluate the potential of integrating detailed chemistry into CFD calculations, in order to improve predictions and gain more insight in involved processes. This work has been carried out using the capabilities of OpenFOAM ©code, which provides an opensource framework for 3D-CFD simulations, including an ODE solver for solving chemical kinetics. As a general methodology, this study is based on simulating free n-heptane sprays injected into a constant volume vessel, corresponding to the conditions of the experimental database provided by Sandia National Laboratories. Calculations results have been compared to experiments, evaluating the effect of a wide range of ambient conditions on spray ignition and combustion characteristics. Specifically, this research checks the performance of some relevant n-heptane oxidation mechanisms found in the literature, with different degree of complexity, for modelling the chemical history of the fuel. The results of this investigation show the relative influence of chemical mechanism on spray/flame structure in terms of ignition delay and also ignition and flame stabilisation sites. The comprehensive mechanism performs generally better than more simplified chemistry models. However, its accuracy is also compromised for modelling advanced diesel-like combustion concepts based on injecting the spray into a low oxygen concentration environment. © 2010 Elsevier Ltd.
- Published
- 2011
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