The issue of spontaneous ignition of highly pressurized hydrogen release is of important safety concern, e.g. in the assessment of safety risk and design of safety measures. This paper reports on recent numerical investigation of this phenomenon through releases via a tube using a 5th-order WENO scheme. A mixture-averaged multi-component approach was used for accurate calculation of molecular transport. The auto-ignition and combustion chemistry were accounted for using a 21-step kinetic scheme. The numerical study revealed that the finite rupture process of the initial pressure boundary plays an important role in the spontaneous ignition. The rupture process induces significant turbulent mixing at the contact region via shock reflections and interactions. The predicted leading shock velocity inside the tube increases during the early stages of the release and then stabilizes at a constant value. The air behind the leading shock is shock-heated and mixes with the released hydrogen in the contact region. Ignition is firstly initiated inside the tube and then a partially premixed flame is developed. Significant amount of shock-heated air and well developed partially premixed flames are two major factors providing potential energy to overcome the strong under-expansion and flow divergence following spouting from the tube. Further parametric studies were conducted to investigate the effect of rupture time, release pressure, tube length and diameter on the likelihood of spontaneous ignition. A slower rupture time and a lower release pressure will lead to increases in ignition delay time and hence reduces the likelihood of spontaneous ignition. If the tube length is smaller than a certain value, even though ignition could take place inside the tube, the flame is unlikely to be sufficiently strong to overcome under-expansion and flow divergence after spouting from the tube and hence is likely to be quenched.

The main objective of this study is an insight into physical phenomena underlying spontaneous ignition of hydrogen at sudden release from high pressure storage and its transition into the sustained jet fire. This paper describes modelling and large eddy simulation (LES) of spontaneous ignition dynamics in a tube with a rupture disk separating high pressure hydrogen storage and the atmosphere. Numerical experiments carried out by a LES model have provided an insight into the physics of the spontaneous ignition phenomenon. It is demonstrated that a chemical reaction commences in a boundary layer within the tube, and propagates throughout the tube cross-section after that. Simulated by the LES model dynamics of flame formation outside the tube has reproduced experimental observation of combustion by high-speed photography, including vortex induced "flame separation". It is concluded that the model developed can be applied for hydrogen safety engineering, in particular for development of innovative pressure relief devices.

This paper describes a large eddy simulation model of hydrogen spontaneous ignition in a T-shaped channel filled with air following an inertial flat burst disk rupture. This is the first time when 3D simulations of the phenomenon are performed and reproduced experimental results by Golub et al. (2010). The eddy dissipation concept with a full hydrogen oxidation in air scheme is applied as a sub-grid scale combustion model to enable use of a comparatively coarse grid to undertake 3D simulations. The renormalization group theory is used for sub-grid scale turbulence modelling. Simulation results are compared against test data on hydrogen release into a T-shaped channel at pressure 1.2-2.9 MPa and helped to explain experimental observations. Transitional phenomena of hydrogen ignition and self-extinction at the lower pressure limit are simulated for a range of storage pressure. It is shown that there is no ignition at storage pressure of 1.35 MPa. Sudden release at pressure 1.65 MPa and 2.43 MPa has a localised spot ignition of a hydrogen-air mixture that quickly self-extinguishes. There is an ignition and development of combustion in a flammable mixture cocoon outside the T-shaped channel only at the highest simulated pressure of 2.9 MPa. Both simulated phenomena i.e. the initiation of chemical reactions followed by the extinction, and the progressive development of combustion in the T-shape channel and outside, have provided an insight into interpretation of the experimental data. The model can be used as a tool for hydrogen safety engineering in particular for development of innovative pressure relief devices with controlled ignition.

Numerical investigations have been conducted on the effect of the internal geometry of a local contraction on the spontaneous ignition of pressurized hydrogen release through a length of tube using a 5th-order WENO scheme. A mixture-averaged multi-component approach was used for accurate calculation of molecular transport. The auto-ignition and combustion chemistry were accounted for using a 21-step kinetic scheme. It is found that the internal geometry of a local contraction can significantly facilitate the occurrence of spontaneous ignition by producing elevated flammable mixture and enhancing turbulent mixing from shock formation, reflection and interaction. The first ignition kernel is observed upstream the contraction. It then quickly propagates along the contact interface and transits to a partially premixed flame due to the enhanced turbulent mixing. The partially premixed flames are highly distorted and overlapped with each other. Flame thickening is observed due to the merge of thin flames. The numerical predictions suggested that sustained flames could develop for release pressure as low as 25 bar. For the release pressure of 18 bar, spontaneous ignition was predicted but the flame was soon quenched. To some extent this finding is consistent with Dryer?s experimental observation in that the minimum release pressure for the release through a tube with internal geometries is only 20.4bar.

Spontaneous ignition processes due to the high-pressure hydrogen releases into air were investigated both experimentally and theoretically. Such processes reproduce accident scenarios of sudden expansion of pressurized hydrogen into the ambient atmosphere in cases of tube or valve rupture. High-pressure hydrogen releases in the range of initial pressures from 20 to 275 bar and with nozzle diameters of 0.5-4mm have been investigated. Glass tubes and high-speed CCD camera were used for experimental study of self-ignition process. The problem was theoretically considered in terms of contact discontinuity for the case when spontaneous ignition of pressurized hydrogen due to the contact with hot pressurized air occurs. The effects of boundary layer and material properties are discussed in order to explain the minimum initial pressure of 25 bar leading to the self-ignition of hydrogen with air.