Plug-Flow Reactor Study of the Partial Oxidation of Methane and Natural Gas at Ultra-Rich Conditions

References

• Amano, T., and Dryer, F.L. 1998. Effect of dimethyl ether, NOx, and ethane on CH4 oxidation: high pressure, intermediate-temperature experiments and modeling. Proc. Combust. Inst., 27, 397–404. doi:10.1016/S0082-0784(98)80428-1
   Google Scholar
• Arutyunov, V.S., Rudakov, V.M., Savchenko, V.I., Sheverdenkin, E.V., Sheverdenkina, O.G., and Zheltyakov, A.Y. 2002. Partial alkane oxidation kinetics at high pressures: methane oxidation in stainless steel and quartz reactors. Theor. Found. Chem. Eng., 36, 472–476. doi:10.1023/A:1020677829300
   Web of Science ®Google Scholar
• Atakan, B. 2011. Gas turbines for polygeneration? A thermodynamic investigation of a fuel rich gas turbine cycle. Int. J. Thermodyn., 14, 185–192. doi:10.5541/ijot.308
   Google Scholar
• Aul, C.J., Metcalfe, W.K., Burke, S.M., Curran, H.J., and Petersen, E.L. 2013. Ignition and kinetic modeling of methane and ethane fuel blends with oxygen: a design of experiments approach. Combust. Flame, 160, 1153–1167. doi:10.1016/j.combustflame.2013.01.019
   Web of Science ®Google Scholar
• Battin-Leclerc, F. 2008. Detailed chemical kinetic models for the low-temperature combustion of hydrocarbons with application to gasoline and diesel fuel surrogates. Prog. Energy Combust. Sci., 34, 440–498. doi:10.1016/j.pecs.2007.10.002
   Web of Science ®Google Scholar
• Burch, R., Squire, G.D., and Tsang, S.C. 1989. Direct conversion of methane into methanol. J. Chem. Soc., Faraday Trans., 1(85), 3561–3568. doi:10.1039/f19898503561
   Google Scholar
• Burke, U., Somers, K.P., O’Toole, P., Zinner, C.M., Marquet, N., Bourque, G., Petersen, E.L., Metcalfe, W.K., Serinyel, Z., and Curran, H.J. 2015. An ignition delay and kinetic modeling study of methane, dimethyl ether, and their mixtures at high pressures. Combust. Flame, 162, 315–330. doi:10.1016/j.combustflame.2014.08.014
   Web of Science ®Google Scholar
• Dagaut, P., Boettner, J.-C., and Cathonnet, M. 1991. Methane oxidation: experimental and kinetic modeling study. Combust. Sci. Technol., 77, 127–148. doi:10.1080/00102209108951723
   Web of Science ®Google Scholar
• Dagaut, P., and Dayma, G. 2006. Hydrogen-enriched natural gas blend oxidation under high-pressure conditions: experimental and detailed chemical kinetic modeling. Int. J. Hydrogen Energy, 31, 505–515. doi:10.1016/j.ijhydene.2005.04.020
   Web of Science ®Google Scholar
• Dagaut, P., and Nicolle, A. 2005. Experimental and detailed kinetic modeling study of hydrogen-enriched natural gas blend oxidation over extended temperature and equivalence ratio ranges. Proc. Combust. Inst., 30, 2631–2638. doi:10.1016/j.proci.2004.07.030
   Web of Science ®Google Scholar
• Dames, E.E., Rosen, A.S., Weber, B.W., Gao, C.W., Sung, C.-J., and Green, W.H. 2016. A detailed combined experimental and theoretical study on dimethyl ether/propane blended oxidation. Combust. Flame, 168, 310–330. doi:10.1016/j.combustflame.2016.02.021
   Web of Science ®Google Scholar
• Donohoe, N., Heufer, A., Metcalfe, W.K., Curran, H.J., Davis, M.L., Mathieu, O., Plichta, D., Morones, A., Petersen, E.L., and Güthe, F. 2014. Ignition delay times, laminar flame speeds, and mechanism validation for natural gas/hydrogen blends at elevated pressures. Combust. Flame, 161, 1432–1443. doi:10.1016/j.combustflame.2013.12.005
   Web of Science ®Google Scholar
• El Bakali, A., Dagaut, P., Pillier, L., Desgroux, P., Pauwels, J.-F., Rida, A., and Meunier, P. 2004. Experimental and modeling study of the oxidation of natural gas in a premixed flame, shock tube, and jet-stirred reactor. Combust. Flame, 137, 109–128. doi:10.1016/j.combustflame.2004.01.004
   Web of Science ®Google Scholar
• Gallagher, S.M., Curran, H.J., Metcalfe, W.K., Healy, D., Simmie, J.M., and Bourque, G. 2008. A rapid compression machine study of the oxidation of propane in the negative temperature coefficient regime. Combust. Flame, 153, 316–333. doi:10.1016/j.combustflame.2007.09.004
   Web of Science ®Google Scholar
• Glarborg, P., and Bentzen, L.L.B. 2008. Chemical effects of a high CO2 concentration in oxy-fuel combustion of methane. Energy Fuels, 22, 291–296. doi:10.1021/ef7005854
   Web of Science ®Google Scholar
• Gossler, H., and Deutschmann, O. 2015. Numerical optimization and reaction flow analysis of syngas production via partial oxidation of natural gas in internal combustion engines. Int. J. Hydrogen Energy, 40, 11046–11058. doi:10.1016/j.ijhydene.2015.06.125
   Web of Science ®Google Scholar
• Hashemi, H., Christensen, J.M., Gersen, S., Levinsky, H., Klippenstein, S.J., and Glarborg, P. 2016. High-pressure oxidation of methane. Combust. Flame, 172, 349–364. doi:10.1016/j.combustflame.2016.07.016
   Web of Science ®Google Scholar
• Hashemi, H., Christensen, J.M., Harding, L.B., Klippenstein, S.J., and Glarborg, P. 2018. High-pressure oxidation of propane. Proc. Combust. Inst., In Press. doi:10.1016/j.proci.2018.07.009
   PubMed Web of Science ®Google Scholar
• Healy, D., Curran, H.J., Simmie, J.M., Kalitan, D.M., Zinner, C.M., Barrett, A.B., Petersen, E.L., and Bourque, G. 2008. Methane/ethane/propane mixture oxidation at high pressures and at high, intermediate and low temperatures. Combust. Flame, 155, 441–448. doi:10.1016/j.combustflame.2008.07.003
   Web of Science ®Google Scholar
• Hegner, R., and Atakan, B. 2017. A polygeneration process concept for HCCI-engines - modeling product gas purification and exergy losses. Int. J. Hydrogen Energy, 42, 1287–1297. doi:10.1016/j.ijhydene.2016.09.050
   Web of Science ®Google Scholar
• Hegner, R., Werler, M., Schiessl, R., Maas, U., and Atakan, B. 2017. Fuel-rich HCCI-engines as chemical reactors for polygeneration: a modeling and experimental study on product species and thermodynamics. Energy Fuels, 31, 14079–14088. doi:10.1021/acs.energyfuels.7b02150
   Web of Science ®Google Scholar
• Hunter, T.B., Wang, H., Litzinger, T.A., and Frenklach, M. 1994. The oxidation of methane at elevated pressures: experiments and modeling. Combust. Flame, 97, 201–224. doi:10.1016/0010-2180(94)90005-1
   Web of Science ®Google Scholar
• Kintech Laboratory. 2016. Chemical WorkBench® 4.1.
   Google Scholar
• Li, Z., Cheng, X., Wei, W., Qiu, L., and Wu, H. 2017. Effects of hydrogen addition on laminar flame speeds of methane, ethane and propane: experimental and numerical analysis. Int. J. Hydrogen Energy, 42, 24055–24066. doi:10.1016/j.ijhydene.2017.07.190
   Web of Science ®Google Scholar
• Nilsson, E.J.K., van Sprang, A., Larfeldt, J., and Konnov, A.A. 2017. The comparative and combined effects of hydrogen addition on the laminar burning velocities of methane and its blends with ethane and propane. Fuel, 189, 369–376. doi:10.1016/j.fuel.2016.10.103
   Web of Science ®Google Scholar
• Petersen, E.L., Kalitan, D.M., Simmons, S., Bourque, G., Curran, H.J., and Simmie, J.M. 2007. Methane/propane oxidation at high pressures: experimental and detailed chemical kinetic modeling. Proc. Combust. Inst., 31, 447–454. doi:10.1016/j.proci.2006.08.034
   Web of Science ®Google Scholar
• Rasmussen, C.L., and Glarborg, P. 2008. Direct partial oxidation of natural gas to liquid chemicals: chemical kinetic modeling and global optimization. Ind. Eng. Chem. Res., 47, 6579–6588. doi:10.1021/ie800137d
   Web of Science ®Google Scholar
• Rasmussen, C.L., Jakobsen, J.G., and Glarborg, P. 2008. Experimental measurements and kinetic modeling of CH4/O2 and CH4/C2H6/O2 conversion at high pressure. Int. J. Chem. Kinet., 40, 454–480. doi:10.1002/kin.20327
   Web of Science ®Google Scholar
• Rytz, D.W., and Baiker, A. 1991. Partial oxidation of methane to methanol in a flow reactor at elevated pressure. Ind. Eng. Chem. Res., 30, 2287–2292. doi:10.1021/ie00058a007
   Web of Science ®Google Scholar
• Sen, F., Shu, B., Kasper, T., Herzler, J., Welz, O., Fikri, M., Atakan, B., and Schulz, C. 2016. Shock-tube and plug-flow reactor study of the oxidation of fuel-rich CH4/O2 mixtures enhanced with additives. Combust. Flame, 169, 307–320. doi:10.1016/j.combustflame.2016.03.030
   Web of Science ®Google Scholar
• Tan, Y., Dagaut, P., Cathonnet, M., Claude Boettner, J., Sylvain Bachman, J., and Carlier, P. 1994. Natural gas and blends oxidation and ignition: experiments and modeling. Proc. Combust. Inst., 25, 1563–1569. doi:10.1016/S0082-0784(06)80801-5
   Google Scholar
• Wiemann, S., Hegner, R., Atakan, B., Schulz, C., and Kaiser, S.A. 2018. Combined production of power and syngas in an internal combustion engine – experiments and simulations in SI and HCCI mode. Fuel, 215, 40–45. doi:10.1016/j.fuel.2017.11.002
   Web of Science ®Google Scholar
• Zhou, C.-W., Li, Y., Burke, U., Banyon, C., Somers, K.P., Ding, S., Khan, S., Hargis, J.W., Sikes, T., Mathieu, O., Petersen, E.L., AlAbbad, M., Farooq, A., Pan, Y., Zhang, Y., Huang, Z., Lopez, J., Loparo, Z., Vasu, S.S., and Curran, H.J. 2018. An experimental and chemical kinetic modeling study of 1,3-butadiene combustion: ignition delay time and laminar flame speed measurements. Combust. Flame, 197, 423–438. doi:10.1016/j.combustflame.2018.08.006
   Web of Science ®Google Scholar
• Zhou, X., Chen, C., and Wang, F. 2010. Modeling of non-catalytic partial oxidation of natural gas under conditions found in industrial reformers. Chem. Eng. Process, 49, 59–64. doi:10.1016/j.cep.2009.11.006
   Web of Science ®Google Scholar