Modeling and simulation of hydrogen combustion in engines

Abstract Hydrogen being an ecological fuel is very attractive now for engines designers. It is already actively used in rocket engines. There exist plans to use hydrogen in pulse detonation engines. However, peculiarities of hydrogen combustion kinetics, the presence of zones of inverse dependence of reaction rate on pressure, etc. prevent from wide use of hydrogen engines. Computer aided design of new effective and clean hydrogen engines needs mathematical tools for supercomputer modeling of hydrogen–oxygen components mixing and combustion gas dynamics. The paper presents the results of developing verification and validation of mathematical model and numerical tool making it possible to simulate unsteady processes of ignition and combustion in engines of different types and to study its peculiarities. First, verification and validation of the chemical kinetic models for hydrogen oxidation were carried out through investigations on the ignition delay time on pressure, temperature, and equivalence ratio for hydrogen-oxygen mixtures. Then, the developed solver was used to model pre-mixed and non-premixed combustion and detonation related phenomena including deflagration to detonation transition.

[1]  F. Jouot,et al.  Experimental study of detonation in a cryogenic two-phase H2–O2 flow , 2011 .

[2]  Nickolay Smirnov,et al.  Experimental investigation of deflagration to detonation transition in hydrocarbon-air gaseous mixtures , 1995 .

[3]  A. A. Borisov On the origin of exothermic centers in gaseous mixtures , 1974 .

[4]  Nickolay Smirnov,et al.  Microgravity investigation of laminar flame propagation in monodisperse gas droplet mixtures , 2007 .

[5]  M. Radulescu,et al.  Detonation re-initiation mechanism following the Mach reflection of a quenched detonation , 2012, 1202.2318.

[6]  M. W. Slack,et al.  Rate coefficient for H + O2 + M = HO2 + M evaluated from shock tube measurements of induction times , 1977 .

[7]  G. Thomas,et al.  Experimental studies of shock-induced ignition and transition to detonation in ethylene and propane mixtures , 1999 .

[8]  Ronald K. Hanson,et al.  An improved H2/O2 mechanism based on recent shock tube/laser absorption measurements , 2011 .

[9]  M. F. Ivanov,et al.  Deflagration-to-Detonation Transition in Highly Reactive Combustible Mixtures , 2010 .

[10]  C. Law,et al.  Gas Compression Moderates Flame Acceleration in Deflagration-to-Detonation Transition , 2012, 1203.1205.

[11]  M. P. Burke,et al.  Comprehensive H2/O2 kinetic model for high‐pressure combustion , 2012 .

[12]  A. Merzhanov,et al.  On critical conditions for thermal explosion of a hot spot , 1966 .

[13]  Nickolay Smirnov,et al.  Investigation of Self-Sustaining Waves in Metastable Systems: Deflagration-to-Detonation Transition , 2009 .

[14]  Elaine S. Oran,et al.  Ignition of flamelets behind incident shock waves and the transition to detonation. Memorandum report , 1983 .

[15]  O. Pironneau,et al.  Analysis of the K-epsilon turbulence model , 1994 .

[16]  Ulrich Maas,et al.  Simplifying chemical kinetics: Intrinsic low-dimensional manifolds in composition space , 1992 .

[17]  Ulrich Maas,et al.  Ignition processes in hydrogenoxygen mixtures , 1988 .

[18]  Mikhail V. Silnikov,et al.  Thermo-Gas Dynamics of Hydrogen Combustion and Explosion , 2012 .

[19]  R. I. Soloukhin,et al.  Gas ignition behind the shock wave , 1958 .

[20]  Nickolay Smirnov,et al.  Mathematical simulation for non-equilibrium droplet evaporation , 2007 .

[21]  V. F. Nikitin,et al.  The influence of confinement geometry on deflagration to detonation transition in gases , 2002 .

[22]  V. F. Nikitin,et al.  Pulse detonation engines: Technical approaches , 2009 .

[23]  Genny A. Pang,et al.  Experimental study and modeling of shock tube ignition delay times for hydrogen–oxygen–argon mixtures at low temperatures , 2009 .

[24]  Elaine S. Oran,et al.  Numerical simulation of detonation initiation in a flame brush : The role of hot spots , 1999 .

[25]  Nickolay Smirnov,et al.  Deflagration-to-detonation transition in gases in tubes with cavities , 2010 .

[26]  A. K. Oppenheim,et al.  Experimental observations of the transition to detonation in an explosive gas , 1966, Proceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences.

[27]  Nickolay Smirnov,et al.  Effect of Channel Geometry and Mixture Temperature on Detonation‐to‐Deflagration Transition in Gases , 2004 .

[28]  Nickolay Smirnov,et al.  Evaporation and ignition of droplets in combustion chambers modeling and simulation , 2012 .