Effects of Addition on Methane Ignition: Toward a Kinetic Understanding for Marine Engine Applications
Publication: Journal of Energy Engineering
Volume 147, Issue 3
Abstract
This paper presents a computational study of the effects of nitrogen and sulfur oxides doping on the ignition of methane-air mixtures under marine engine–like conditions. The performance of four detailed chemical kinetic mechanisms, appropriately coupled with nitrogen and sulfur chemistry reactions, is first assessed against literature experiments. An assembled mechanism is thus adopted and used to investigate doping effects on the ignition of homogeneous methane mixtures for a wide variation of pressure, temperature, equivalence ratio, and doping concentrations. Extensive rate-of-production analysis is performed in order to delineate chemical effects on ignition. The present results confirm that, in general, the addition of either NO or reduces ignition delay time. is found to be more drastic than NO at intermediate pressure; this trend is milder at high pressure. The effects of on ignition chemistry are not significant. An outcome of the present study is thus an operating grid, relevant for controlling marine engine combustion. The assembled mechanism, subject to reduction, can be used in marine engine computational fluid dynamics (CFD) studies.
Get full access to this article
View all available purchase options and get full access to this article.
Data Availability Statement
All data, models, and code generated or used during the study appear in the published article.
Acknowledgments
D. Kazangas gratefully acknowledges the financial support of the scholarship fellowship of the Research Committee (ELKE) of the National Technical University of Athens (NTUA). L. Kaiktsis acknowledges the financial support of the ECCO-MATE MC FP7-PEOPLE-2013-ITN (607214) Project. G. Skevis acknowledges the financial support of the MemCCSea Project (Accelerating CCS Technologies, Horizon 2020 Project No. 294766). All authors acknowledge the financial support of the SMARTCATS CM1404 COST Action.
References
Bongartz, D., and A. F. Ghoniem. 2015. “Chemical kinetics mechanism for oxy-fuel combustion of mixtures of hydrogen sulfide and methane.” Combust. Flame 162 (3): 544–553. https://doi.org/10.1016/j.combustflame.2014.08.019.
Burke, S. M., et al. 2015. “An experimental and modeling study of propene oxidation. Part 2: Ignition delay time and flame speed measurements.” Combust. Flame 162 (2): 296–314. https://doi.org/10.1016/j.combustflame.2014.07.032.
Burke, S. M., W. Metcalfe, O. Herbine, F. Battin-Leclerc, F. M. Haas, J. Santner, L. D. Frederick, and H. J. Curran. 2014. “An experimental and modeling study of propene oxidation. Part 1: Speciation measurements in jet-stirred and flow reactors.” Combust. Flame 161 (11): 2765–2784. https://doi.org/10.1016/j.combustflame.2014.05.010.
Burke, U., W. K. Metcalfe, S. M. Burke, K. A. Heufer, P. Dagaut, and H. J. Curran. 2016. “A detailed chemical kinetic modeling, ignition delay time and jet-stirred reactor study of methanol oxidation.” Combust. Flame 165 (Mar): 125–136. https://doi.org/10.1016/j.combustflame.2015.11.004.
CIMAC (International Council on Combustion Engines). 2008. Guide to diesel exhaust emissions control of NOx, SOx, particulates, smoke and CO2: Seagoing ships and large stationary diesel power plants. Frankfurt, Germany: CIMAC Central Secretariat.
Cuoci, A., A. Frassoldati, T. Faravelli, and E. Ranzi. 2009. “Formation of soot and nitrogen oxides in unsteady counterflow diffusion flames.” Combust. Flame 156 (10): 2010–2022. https://doi.org/10.1016/j.combustflame.2009.06.023.
Dagaut, P., and A. Nicolle. 2005a. “Experimental and kinetic modeling study of the effect of sulfur dioxide on the mutual sensitization of the oxidation of nitric oxide and methane.” Int. J. Chem. Kinet. 37 (7): 406–413. https://doi.org/10.1002/kin.20100.
Dagaut, P., and A. Nicolle. 2005b. “Experimental study and detailed kinetic modeling of the effect of exhaust gas on fuel combustion: Mutual sensitization of the oxidation of nitric oxide and methane over extended temperature and pressure ranges.” Combust. Flame 140 (3): 161–171. https://doi.org/10.1016/j.combustflame.2004.11.003.
Deng, F., F. Yang, P. Zhang, Y. Pan, J. Bugler, H. J. Curran, and Z. Huang. 2016. “Towards a kinetic understanding of the promoting-effect on ignition of coalbed methane: A case study of methane/nitrogen dioxide mixtures.” Fuel 181 (Oct): 188–198. https://doi.org/10.1016/j.fuel.2016.04.090.
Faravelli, T., A. Frassoldati, and E. Ranzi. 2003. “Kinetic modeling of the interactions between NO and hydrocarbons in the oxidation of hydrocarbons at low temperatures.” Combust. Flame 132 (1–2): 188–207. https://doi.org/10.1016/S0010-2180(02)00437-6.
Fokas, N., F. Perdikaris, D. Kazangas, G. Skevis, and L. Kaiktsis. 2018. “Development of an optimized skeletal chemical kinetic mechanism for methane combustion for marine engine applications.” Energy Fuels 32 (10): 10272–10284. https://doi.org/10.1021/acs.energyfuels.8b01118.
Frassoldati, A., T. Faravelli, and E. Ranzi. 2003. “Kinetic modeling of the interactions between NO and hydrocarbons at high temperature.” Combust. Flame 135 (1–2): 97–112. https://doi.org/10.1016/S0010-2180(03)00152-4.
Gersen, S., A. V. Mokhov, J. H. Darmeveil, H. B. Levinsky, and P. Glarborg. 2011. “Ignition-promoting effect of on methane, ethane and methane/ethane mixtures in a rapid compression machine.” Proc. Combust. Inst. 33 (1): 433–440. https://doi.org/10.1016/j.proci.2010.05.097.
Gersen, S., M. van Essen, H. Darmeveil, H. Hashemi, C. T. Rasmussen, J. M. Christensen, P. Glarborg, and H. Levinsky. 2016. “Experimental and modeling investigation of the effect of H2S addition to methane on the ignition and oxidation at high pressures.” Energy Fuels 31 (3): 2175–2182. https://doi.org/10.1021/acs.energyfuels.6b02140.
Glarborg, P. 2007. “Hidden interactions—Trace species governing combustion and emissions.” Proc. Combust. Inst. 31 (1): 77–98. https://doi.org/10.1016/j.proci.2006.08.119.
Gokulakrishnan, P., C. C. Fuller, and M. S. Klassen. 2017. “Experimental and modeling study of to hydrocarbon ignition in the presence of nitric oxide.” J. Eng. Gas Turb. Power 140 (4): 041509. https://doi.org/10.1115/1.4038079.
Karimi, M., B. Ochs, Z. Liu, D. Ranjan, and W. Sun. 2019. “Measurement of methane autoignition delays in carbon dioxide and argon diluents at high pressure conditions.” Combust. Flame 204 (Jun): 304–319. https://doi.org/10.1016/j.combustflame.2019.03.020.
Kee, R. J., F. M. Rupley, and J. A. Miller. 1989. CHEMKIN-II: A Fortran chemical kinetics package for the analysis of gas-phase chemical kinetics. Livermore, CA: Sandia National Laboratories.
Kéromnès, A., et al. 2013. “An experimental and detailed chemical kinetic modeling study of hydrogen and syngas mixture oxidation at elevated pressures.” Combust. Flame 160 (6): 995–1011. https://doi.org/10.1016/j.combustflame.2013.01.001.
Kontoulis, P., L. Kaiktsis, B. von Rotz, and K. Boulouchos. 2019. “CFD modeling and experimental spray studies for different heavy fuel oil qualities with respect to large two-stroke marine engines.” J. Energy Eng. 145 (5): 04019014. https://doi.org/10.1061/(ASCE)EY.1943-7897.0000610.
Kovács, M., M. Papp, I. G. Zsély, and T. Turányi. 2019. “Determination of rate parameters of key N/H/O elementary reactions based on H2/O2/NOx combustion experiments.” Fuel 264 (Mar): 116720. https://doi.org/10.1016/j.fuel.2019.116720.
Le Cong, T., P. Dagaut, and G. Dayma. 2008. “Oxidation of natural gas, natural gas/syngas mixtures, and effect of burnt gas recirculation: Experimental and detailed kinetic modeling.” J. Eng. Gas Turb. Power 130 (4): 041502–041511. https://doi.org/10.1115/1.2901181.
Li, Y., C.-W. Zhou, K. P. Somers, K. Zhang, and H. J. Curran. 2017. “The oxidation of 2-butene: A high pressure ignition delay, kinetic modeling study and reactivity comparison with isobutene and 1-butene.” Proc. Combust. Inst. 36 (1): 403–411. https://doi.org/10.1016/j.proci.2016.05.052.
Lloyd’s Register. 2012. Understanding exhaust gas treatment systems: Guidance for shipowners and operators. London: Lloyd’s Register.
MAN Energy Solutions. 2018. MAN B&W two-stroke marine engines emission project guide for Marpol Annex VI regulations. Augsburg, Germany: MAN Energy Solutions.
Mathieu, O., J. M. Pemelton, G. Bourque, and E. L. Petersen. 2015. “Shock-induced ignition of methane sensitized by NO2 and N2O.” Combust. Flame 162 (8): 3053–3070. https://doi.org/10.1016/j.combustflame.2015.03.024.
MEPC (Marine Environment Protection Committee). 2008. Amendments to the annex of the protocol of 1997 to amend the international convention for the prevention of pollution from ships, 1973, as modified by the protocol of 1978 relating thereto (revised MARPOL annex VI). MEPC.176(58). London: International Maritime Organization.
MEPC (Marine Environment Protection Committee). 2018. Initial IMO strategy on reduction of GHG emissions from ships. MEPC.304(72). London: International Maritime Organization.
Metcalfe, W. K., S. M. Burke, S. S. Ahmed, and H. J. Curran. 2013. “A hierarchical and comparative kinetic modeling study of hydrocarbon and oxygenated fuels.” Int. J. Chem. Kinet. 45 (10): 638–675. https://doi.org/10.1002/kin.20802.
Olm, C., T. Varga, É. Valkó, S. Hartl, C. Hasse, and T. Turányi. 2016. “Development of an ethanol combustion mechanism based on a hierarchical optimization approach.” Int. J. Chem. Kinet. 48 (8): 423–441. https://doi.org/10.1002/kin.20998.
Ranzi, E., A. Frassoldati, R. Grana, A. Cuoci, T. Faravelli, A. P. Kelley, and C. K. Law. 2012. “Hierarchical and comparative kinetic modeling of laminar flame speeds of hydrocarbon and oxygenated fuels.” Prog. Energy Combust. Sci. 38 (4): 468–501. https://doi.org/10.1016/j.pecs.2012.03.004.
Shi, Z., H. Wu, H. Zhang, Z. Wang, C. Lee, and Y. Xu. 2018. “Autoignition of DME/C2H6 mixtures under high-pressure and low-temperature conditions.” Combust. Sci. Technol. 191 (7): 1201–1218. https://doi.org/10.1080/00102202.2018.1517757.
Song, Y., L. Marrodán, N. Vin, O. Herbinet, E. Assaf, C. Fittschen, A. Stagni, T. Faravelli, M. U. Alzueta, and F. Battin-Leclerc. 2019. “The sensitizing effects of and NO on methane low temperature oxidation in a jet stirred reactor.” Proc. Combust. Inst. 37 (1): 667–675. https://doi.org/10.1016/j.proci.2018.06.115.
Stratsianis, V., P. Kontoulis, and L. Kaiktsis. 2016. “Effects of fuel post-injection on the performance and pollutant emissions of a large marine engine.” J. Energy Eng. 142 (2): E4016001. https://doi.org/10.1061/(ASCE)EY.1943-7897.0000337.
Vourliotakis, G., G. Skevis, and M. A. Founti. 2015. “Some aspects of combustion chemistry of C1–C2 oxygenated fuels in low pressure premixed flames.” Proc. Combust. Inst. 35 (1): 437–445. https://doi.org/10.1016/j.proci.2014.06.060.
Wang, C., T. Wang, K. Sun, Z. Lu, and Y. Gui. 2017. Effects of EGR and injection strategies on the performance and emissions of a two-stroke marine diesel engine. Warrendale, PA: Society of Automotive Engineers.
Woodyard, D. 2009. Pounders marine diesel engines and gas turbines. 9th ed. Oxford, UK: Elsevier.
Xanthoulis, N. 2017. “Computational study of fuel injection strategies in a two-stroke marine diesel engine in the presence of EGR.” Master’s thesis, Dept. of Naval Architecture and Marine Engineering, National Technical Univ. of Athens.
Zhang, X., W. Ye, J. C. Shi, X. J. Wu, R. T. Zhang, and S. N. Luo. 2017. “Shock-induced ignition of methane, ethane, and methane/ethane mixtures sensitized by NO2.” Energy Fuels 31 (11): 12780–12790. https://doi.org/10.1021/acs.energyfuels.7b01632.
Zhou, C., K. Sendt, and B. S. Haynes. 2013. “Experimental and kinetic modelling study of H2S oxidation.” Proc. Combust. Inst. 34 (1): 625–632. https://doi.org/10.1016/j.proci.2012.05.083.
Zhou, C. W., et al. 2016. “A comprehensive experimental and modeling study of isobutene oxidation.” Combust. Flame 167 (May): 353–379. https://doi.org/10.1016/j.combustflame.2016.01.021.
Information & Authors
Information
Published In
Copyright
© 2021 American Society of Civil Engineers.
History
Received: Sep 17, 2020
Accepted: Dec 21, 2020
Published online: Feb 27, 2021
Published in print: Jun 1, 2021
Discussion open until: Jul 27, 2021
Authors
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
- Yaorui Shen, Mingke Xie, Xiaoqi Wu, Jingping Liu, Huanhuan Bao, Jianqin Fu, Numerical study on the effects of CO 2 /H 2 O dilution on the ignition delay time of methane , International Journal of Chemical Kinetics, 10.1002/kin.21562, 54, 6, (331-345), (2022).