Technical Papers
Sep 17, 2014

Computational Fluid Dynamics Study of Alternative Nitric-Oxide Emission Mechanisms in a Spark-Ignition Engine Fueled with Hydrogen and Operating in a Wide Range of Exhaust Gas Recirculation Rates for Load Control

Publication: Journal of Energy Engineering
Volume 141, Issue 2

Abstract

Nitric oxide (NO) emissions are practically the only ones emitted from spark-ignition (SI), hydrogen-fueled engines, and their reliable prediction is important in engine simulation codes. In this work, the reaction mechanisms of nitric oxide are investigated in such engines during load variation by using a very wide range of exhaust gas recirculation (EGR) rates, up to 47%. For that purpose, a three-dimensional computational fluid dynamics code is applied, which has been developed by the authors and validated for its main sub-models, such as the heat transfer and combustion. The latter one includes the thermal NO mechanism, widely known as “Zeldovich mechanism,” whereas two alternative production paths have been included, viz. through the NNH and N2O species formation in order to improve the numerical predictions. The NNH path has been shown to be favored under lean and low-temperature combustion conditions, especially for hydrogen flames, whereas the N2O path becomes important for lean flames irrespectively of the fuel used, whereas such flames have many similarities with highly-diluted mixtures by recirculated exhaust gases. The calculations are compared with available measurements concerning the NO exhaust emissions, in order to quantify the applicability of the alternative production paths at such conditions and applications. For the high load cases (low EGR rates) the NO predictions have good accuracy because the thermal NO is the main production path. However, at mid and low engine loads, when the combustion temperature is lower and higher EGR rates are used, a significant discrepancy exists between the calculations and the measured data, which is improved when the NNH route is taken into consideration.

Get full access to this article

View all available purchase options and get full access to this article.

Acknowledgments

The authors would like to thank Prof. S. Verhelst (University of Ghent, Belgium) for the provision of the experimental data. Also, Dr. G.M. Kosmadakis wishes to thank the Greek State Scholarships Foundation for granting him an “IKY Fellowship of excellence for postgraduate studies in Greece—Siemens Program.”

References

Agathou, M. S., and Kyritsis, D. C. (2014). “Experimental study of steady, quasi cone-jet electrostatic sprays of bio-butanol for engine applications.” J. Energy Eng., A4014008.
Aleiferis, P. G., and Rosati, M. F. (2011). “Flame chemiluminescence and OH LIF imaging in a hydrogen-fuelled spark-ignition engine.” Int. J. Hydrogen Energy, 37(2), 1797–1812.
Bozzelli, J. W., Chang, A. Y., and Dean, A. M. (1994). “Analysis of the reactions H+N2O and NH+NO: Pathways and rate constants over a wide range of temperature and pressure.” Symp. (Int.) Combust., 25(1), 965–974.
Bozzelli, J. W., and Dean, A. M. (1995). “O + NNH: A possible new route for NOX formation in flames.” Int. J. Chem. Kinet., 27(11), 1097–1109.
Debnath, B., Bora, B., Sahoo, N., and Saha, U. (2014). “Influence of emulsified palm biodiesel as pilot fuel in a biogas run dual fuel diesel engine.” J. Energy Eng., A4014005.
Demuynck, J., Raes, N., Zuliani, M., De Paepe, M., Sierens, R., and Verhelst, S. (2009). “Local heat flux measurements in a hydrogen and methane spark ignition engine with a thermopile sensor.” Int. J. Hydrogen Energy, 34(24), 9857–9868.
Fan, L., and Reitz, R. D. (2000). “Development of an ignition and combustion model for spark-ignition engines.” Trans. SAE J. Engines, 109, 1977–1989.
Gerke, U., Steurs, K., Rebecchi, P., and Boulouchos, K. (2010). “Derivation of burning velocities of premixed hydrogen/air flames at engine-relevant conditions using a single-cylinder compression machine with optical access.” Int. J. Hydrogen Energy, 35(6), 2566–2577.
Giakoumis, E. G., Rakopoulos, C. D., and Rakopoulos, D. C. (2014). “An assessment of NOx emissions during transient diesel engine operation with biodiesel blends.” J. Energy Eng., A4014004.
Glarborg, P., Johnsson, J. E., and Dam-Johansen, K. (1994). “Kinetics of homogeneous nitrous oxide decomposition.” Combust. Flame, 99(3), 523–532.
Harrington, J. E., Smith, G. P., Berg, P. A., Noble, A. R., Jeffries, J. B., and Crosley, D. R. (1996). “Evidence for a new NO production mechanism in flames.” Symp. (Int.) Combust., 26(2), 2133–2138.
Haworth, N. L., Mackie, J. C., and Bacskay, G. B. (2003). “An ab initio quantum chemical and kinetic study of the NNH + O reaction potential energy surface: How important is this route to NO in combustion?” J. Phys. Chem. A, 107(35), 6792–6803.
Hayhurst, A. N., and Hutchinson, E. M. (1998). “Evidence for a new way of producing NO via NNH in fuel-rich flames at atmospheric pressure.” Combust. Flame, 114(1–2), 274–279.
Hayhurst, A. N., and Lawrence, A. D. (1992). “Emissions of nitrous oxide from combustion sources.” Prog. Energy Combust. Sci., 18(6), 529–552.
Klippenstein, S. J., Harding, L. B., Glarborg, P., and Miller, J. A. (2011). “The role of NNH in NO formation and control.” Combust. Flame, 158(4), 774–789.
Knop, V., Benkenida, A., Jay, S., and Colin, O. (2008). “Modelling of combustion and nitrogen oxide formation in hydrogen-fuelled internal combustion engines within a 3D CFD code.” Int. J. Hydrogen Energy, 33(19), 5083–5097.
Konnov, A. A. (2003). “On the relative importance of different routes forming NO in hydrogen flames.” Combust. Flame, 134(4), 421–424.
Konnov, A. A., Colson, G., and De Ruyck, J. (2001). “NO formation rates for hydrogen combustion in stirred reactors.” Fuel, 80(1), 49–65.
Konnov, A. A., and De Ruyck, J. (2001). “Temperature-dependent rate constant for the reaction NNH + O → NH + NO.” Combust. Flame, 125(4), 1258–1264.
Kosmadakis, G. M., Pariotis, E. G., and Rakopoulos, C. D. (2013). “Heat transfer and crevice flow in a hydrogen-fueled spark-ignition engine: Effect on the engine performance and NO exhaust emissions.” Int. J. Hydrogen Energy, 38(18), 7477–7489.
Kosmadakis, G. M., and Rakopoulos, C. D. (2014). “Computational fluid dynamics investigation of alternative nitric oxide emission mechanisms in a hydrogen-fueled spark-ignition engine.” Int. J. Hydrogen Energy, 39(22), 11774–11791.
Kosmadakis, G. M., Rakopoulos, C. D., Demuynck, J., De Paepe, M., and Verhelst, S. (2012). “CFD modeling and experimental study of combustion and nitric oxide emissions in hydrogen-fueled spark-ignition engine operating in a very wide range of EGR rates.” Int. J. Hydrogen Energy, 37(14), 10917–10934.
Labeckas, G., Slavinskas, S., and Mazeika, M. (2014). “The effect of ethanol–diesel–biodiesel blends on combustion, performance and emissions of a direct injection diesel engine.” Energy Convers. Manage., 79, 698–720.
Lavoie, G. A., Heywood, J. B., and Keck, J. C. (1970). “Experimental and theoretical study of nitric oxide formation in internal combustion engines.” Combust. Sci. Technol., 1(4), 313–326.
Lipatnikov, A. N., and Chomiak, J. (1997). “A simple model of unsteady turbulent flame propagation.” Trans. SAE J. Engines, 106, 2441–2452.
Löffler, G., Sieber, R., Harasek, M., Hofbauer, H., Hauss, R., and Landauf, J. (2006). “NOx formation in natural gas combustion-a new simplified reaction scheme for CFD calculations.” Fuel, 85(4), 513–523.
Malte, P. C., and Pratt, D. T. (1974). “Measurement of atomic oxygen and nitrogen oxides in jet-stirred combustion.” Symp. (Int.) Combust., 15(1), 1061–1070.
Mitsingas, C. M., and Kyritsis, D. C. (2014). “Comparative evaluation of extinction through strain among three alcoholic butanol isomers in non-premixed counterflow flames.” J. Energy Eng., A4014006.
Mohammadi, A., Shioji, M., Nakai, Y., Ishikura, W., and Tabo, E. (2007). “Performance and combustion characteristics of a direct-injection SI hydrogen engine.” Int. J. Hydrogen Energy, 32(2), 296–304.
Nande, A. M., Szwaja, S., and Naber, J. D. (2008). “Impact of EGR on combustion processes in a hydrogen fuelled SI engine.”, Society of Automotive Engineers International, Warrendale, PA.
Papagiannakis, R., and Zannis, T. (2014). “Effect of wood-gas composition on performance and exhaust emission characteristics of a large spark-ignition engine.” J. Energy Eng., A4013002.
Rakopoulos, C. D., and Giakoumis, E. G. (2009). Diesel engine transient operation—Principles of operation and simulation analysis, Springer, London.
Rakopoulos, C. D., Kosmadakis, G. M., Demuynck, J., De Paepe, M., and Verhelst, S. (2011a). “A combined experimental and numerical study of thermal processes, performance and nitric oxide emissions in a hydrogen-fueled spark-ignition engine.” Int. J. Hydrogen Energy, 36(8), 5163–5180.
Rakopoulos, C. D., Kosmadakis, G. M., Dimaratos, A. M., and Pariotis, E. G. (2011b). “Investigating the effect of crevice flow on internal combustion engines using a new simple crevice model implemented in a CFD code.” Appl. Energy, 88(1), 111–126.
Rakopoulos, C. D., Kosmadakis, G. M., and Pariotis, E. G. (2009). “Evaluation of a new computational fluid dynamics model for internal combustion engines using hydrogen under motoring conditions.” Energy, 34(12), 2158–2166.
Rakopoulos, C. D., Kosmadakis, G. M., and Pariotis, E. G. (2010). “Evaluation of a combustion model for the simulation of hydrogen spark-ignition engines using a CFD code.” Int. J. Hydrogen Energy, 35(22), 12545–12560.
Rakopoulos, C. D., and Kyritsis, D. C. (2006). “Hydrogen enrichment effects on the second law analysis of natural and landfill gas combustion in engine cylinders.” Int. J. Hydrogen Energy, 31(10), 1384–1393.
Rakopoulos, C. D., and Michos, C. N. (2009). “Generation of combustion irreversibilities in a spark ignition engine under biogas-hydrogen mixtures fueling.” Int. J. Hydrogen Energy, 34(10), 4422–4437.
Rakopoulos, C. D., Michos, C. N., and Giakoumis, E. G. (2008a). “Availability analysis of a syngas fueled spark ignition engine using a multi-zone combustion model.” Energy, 33(9), 1378–1398.
Rakopoulos, C. D., Scott, M. A., Kyritsis, D. C., and Giakoumis, E. G. (2008b). “Availability analysis of hydrogen/natural gas blends combustion in internal combustion engines.” Energy, 33(2), 248–255.
Rakopoulos, D. C. (2012). “Heat release analysis of combustion in heavy-duty turbocharged diesel engine operating on blends of diesel fuel with cottonseed or sunflower oils and their bio-diesel.” Fuel, 96, 524–534.
Rakopoulos, D. C. (2013). “Combustion and emissions of cottonseed oil and its bio-diesel in blends with either n-butanol or diethyl ether in HSDI diesel engine.” Fuel, 105, 603–613.
Rakopoulos, D. C., Rakopoulos, C. D., Giakoumis, E. G., and Dimaratos, A. M. (2012). “Characteristics of performance and emissions in high-speed direct injection diesel engine fueled with diethyl ether/diesel fuel blends.” Energy, 43(1), 214–224.
Rakopoulos, D. C., Rakopoulos, C. D., Giakoumis, E. G., Dimaratos, A. M., and Kakaras, E. C. (2014). “Comparative evaluation of two straight vegetable oils and their methyl ester bio-diesels as fuel extenders in HDDI diesel engine: Performance and emissions.” J. Energy Eng., A4014001.
Safari, H., Jazayeri, S. A., and Ebrahimi, R. (2009). “Potentials of NOX emission reduction methods in SI hydrogen engines: Simulation study.” Int. J. Hydrogen Energy, 34(2), 1015–1025.
Santoro, V. S., Kyritsis, D. C., Smooke, M. D., and Gomez, A. (2002). “Nitric oxide formation during flame/vortex interaction.” Proc. Combust. Inst., 29(2), 2227–2233.
Srinivasan, K. K., Krishnan, S. R., Qi, Y., Midkiff, K. C., and Yang, H. (2007). “Analysis of diesel pilot-ignited natural gas low-temperature combustion with hot exhaust gas recirculation.” Combust. Sci. Technol., 179(9), 1737–1776.
Verhelst, S. (2014). “Recent progress in the use of hydrogen as a fuel for internal combustion engines.” Int. J. Hydrogen Energy, 39(2), 1071–1085.
Verhelst, S., and Sierens, R. (2007a). “A quasi-dimensional model for the power cycle of a hydrogen-fuelled ICE.” Int. J. Hydrogen Energy, 32(15), 3545–3554.
Verhelst, S., and Sierens, R. (2007b). “Combustion studies for PFI hydrogen IC engines.”, Society of Automotive Engineers International, Warrendale, PA.
Verhelst, S., T’Joen, C., Vancoillie, J., and Demuynck, J. (2011). “A correlation for the laminar burning velocity for use in hydrogen spark ignition engine simulation.” Int. J. Hydrogen Energy, 36(1), 957–974.
Verhelst, S., and Wallner, T. (2009). “Hydrogen-fueled internal combustion engines.” Prog. Energy Combust. Sci, 35(6), 490–527.
Wang, S., Ji, C., and Zhang, B. (2010). “Effect of hydrogen addition on combustion and emissions performance of a spark-ignited ethanol engine at idle and stoichiometric conditions.” Int. J. Hydrogen Energy, 35(17), 9205–9213.
Yang, W., and Blasiak, W. (2005). “Mathematical modelling of NO emissions from high-temperature air combustion with nitrous oxide mechanism.” Fuel Processing Technol., 86(9), 943–957.
Zimont, V. L. (2000). “Gas premixed combustion at high turbulence. Turbulent flame closure combustion model.” Exp. Therm. Fluid Sci., 21(1–3), 179–186.

Information & Authors

Information

Published In

Go to Journal of Energy Engineering
Journal of Energy Engineering
Volume 141Issue 2June 2015

History

Received: May 27, 2014
Accepted: Jul 28, 2014
Published online: Sep 17, 2014
Discussion open until: Feb 17, 2015
Published in print: Jun 1, 2015

Permissions

Request permissions for this article.

Authors

Affiliations

G. M. Kosmadakis [email protected]
Research Associate, School of Mechanical Engineering, National Technical Univ. of Athens, 15780 Athens, Greece (corresponding author). E-mail: [email protected]; [email protected]
C. D. Rakopoulos [email protected]
Professor, School of Mechanical Engineering, National Technical Univ. of Athens, 15780 Athens, Greece. E-mail: [email protected]

Metrics & Citations

Metrics

Citations

Download citation

If you have the appropriate software installed, you can download article citation data to the citation manager of your choice. Simply select your manager software from the list below and click Download.

Cited by

View Options

Get Access

Access content

Please select your options to get access

Log in/Register Log in via your institution (Shibboleth)
ASCE Members: Please log in to see member pricing

Purchase

Save for later Information on ASCE Library Cards
ASCE Library Cards let you download journal articles, proceedings papers, and available book chapters across the entire ASCE Library platform. ASCE Library Cards remain active for 24 months or until all downloads are used. Note: This content will be debited as one download at time of checkout.

Terms of Use: ASCE Library Cards are for individual, personal use only. Reselling, republishing, or forwarding the materials to libraries or reading rooms is prohibited.
ASCE Library Card (5 downloads)
$105.00
Add to cart
ASCE Library Card (20 downloads)
$280.00
Add to cart
Buy Single Article
$35.00
Add to cart

Get Access

Access content

Please select your options to get access

Log in/Register Log in via your institution (Shibboleth)
ASCE Members: Please log in to see member pricing

Purchase

Save for later Information on ASCE Library Cards
ASCE Library Cards let you download journal articles, proceedings papers, and available book chapters across the entire ASCE Library platform. ASCE Library Cards remain active for 24 months or until all downloads are used. Note: This content will be debited as one download at time of checkout.

Terms of Use: ASCE Library Cards are for individual, personal use only. Reselling, republishing, or forwarding the materials to libraries or reading rooms is prohibited.
ASCE Library Card (5 downloads)
$105.00
Add to cart
ASCE Library Card (20 downloads)
$280.00
Add to cart
Buy Single Article
$35.00
Add to cart

Media

Figures

Other

Tables

Share

Share

Copy the content Link

Share with email

Email a colleague

Share