Combined effects of heat loss and curvature on turbulent flame-wall interaction in a premixed dimethyl ether/air flame

This study investigates the effects of curvature on the local heat release rate and mixture fraction during turbulent flame-wall interaction of a lean dimethyl ether/air flame using a fully resolved simulation with a reduced skeletal chemical reaction mechanism and mixture-averaged transport. The region in which turbulent flame-wall interaction affects the flame is found to be restricted to a wall distance less than twice the laminar flame thickness. In regions without heat losses, heat release rate and curvature, as well as mixture fraction and curvature, are negatively correlated, which is in accordance with experimental findings. Flame-wall interaction alters the correlation between heat release rate and curvature. An inversion in the sign of the correlation from negative to positive is observed as the flame starts to experience heat losses to the wall. The correlation between mixture fraction and curvature, however, is unaffected by flame-wall interactions and remains negative. Similarly to experimental findings, the investigated turbulent side-wall quenching flame shows both head-on quenching and side-wall quenching-like behavior. The different quenching events are associated with different curvature values in the near-wall region. Furthermore, for medium heat loss, the correlations between heat release rate and curvature are sensitive to the quenching scenario.     

Turbulent flame propagation limits of ammonia/methane/air premixed mixture in a constant volume vessel

Ammonia is one of promising energy carriers that can be directly used as carbon-neutral fuel for combustion applications. However, because of the low-burning velocity of ammonia, it is challenging to introduce ammonia to practical combustors those are designed for general hydrocarbon fuels. One of ways to enhance the combustibility of ammonia is by mixing it with other hydrocarbon fuels, such as methane, with a burning velocity is much higher than the burning velocity of ammonia. In this study, we conducted flame propagation experiments of ammonia/methane/air using a fan-stirred constant volume vessel to clarify the effect of methane addition to ammonia on the turbulent flame propagation limit. From experimental results, we constructed the flame propagation maps and clarified the flame propagation limits. The results show that the flame propagation limits were extended with an increase in mixing a fraction of methane to ammonia. Additionally, ammonia/methane/air mixtures with the equivalence ration of 0.9 can propagate at the highest turbulent intensity, even though the peak of the laminar burning velocity is the fuel-rich side because of the diffusional-thermal instability of the flame surface. Furthermore, the Markstein number of the mixture obtained in this research successfully expressed the strength of the diffusional-thermal instability effect on the flame propagation capability. The turbulence Karlovitz number at the flame propagation limit monotonically increases with the decreasing Markstein number.     

Effects of cryogenic temperature on premixed hydrogen/air flame propagation in a closed channel

As a carbon-free fuel, hydrogen has received significant attention recently since it can help enable low-carbon-economy. Hydrogen has very broad flammability range and very low minimum ignition energy, and thereby there are severe safety concerns for hydrogen transportation and utilization. Cryo-compressed hydrogen is popularly used in practice. Therefore, it is necessary to investigate the combustion properties of hydrogen at extremely low or cryogenic temperatures. This study aims to assess and interpret the effects of cryogenic temperature on premixed hydrogen/air flame propagation and acceleration in a thin closed channel. Different initial temperatures ranging from normal temperature (T₀ = 300 K) to cryogenic temperature (T₀ = 100 K) are considered. Both one- and two-dimensional hydrogen/air flames are investigated through transient simulations considering detailed chemistry and transport. It is found that when the initial temperature decreases from T₀ = 300 K to T₀ = 100 K, the expansion ratio and equilibrium pressure both increase substantially while the laminar flame speeds relative to unburned and burned gasses decrease moderately. The one-dimensional flame propagation is determined by laminar flame speed and thereby the combustion duration increases as the initial temperature decreases. However, the opposite trend is found to happen to two-dimensional flame propagation, which is mainly controlled by the flame surface area increase due to the no-slip side wall constraint and flame instability. Based on the change in flame surface area, three stages including the initial acceleration, steady burning and rapid acceleration are identified and investigated. It is demonstrated that the large expansion ratio and high pressure rise at cryogenic temperatures can significantly increase the flame surface area in early stage and promote both Darrieus-Landau instability (hydrodynamic instability) and Rayleigh-Taylor instability in later stage. These two instabilities can substantially increase the flame surface area and thereby accelerate flame propagation in hydrogen/air mixtures at cryogenic temperatures. The present study provides useful insights into the fundamental physics of hydrogen flames at extremely low temperatures, and is closely related to hydrogen safety.     

Laser-based investigation of flame surface density and mean reaction rate during flame-wall interaction at elevated pressure

Velocities and flame front locations are measured simultaneously in a turbulent, side-wall quenching (SWQ) V-shaped flame during flame-wall interaction (FWI) at 1 and 3 bar by means of particle image velocimetry (PIV) and planar laser-induced fluorescence of the OH radical (OH-PLIF). The turbulent flame brush is characterized based on the spatial distribution of the mean reaction progress variable and a common direct method is used to derive the flame surface density (FSD) from the two-dimensional data by image processing. As the near-wall reaction zone is limited to a smaller region closer to the wall at higher pressure, higher peak values are observed in the FSD at 3 bar. A second definition of the FSD adapted for flames exposed to quenching is utilized similar to previous studies emphasizing the impact of FWI. The influence of the wall on the flame front topology is investigated based on a flame front-conditioned FSD and its variability within the data set. In a last step, an estimate of the mean reaction rate is deduced using an FSD model and evaluated in terms of integral and space-averaged values. A decreasing trend of integral mean reaction rate in regions with increasing flame quenching is observed for both operating conditions, but more pronounced at 3 bar. Space-averaged mean reaction rates, however, increase in the quenching region, as the size of the reaction zone decreases.     

Effects of electrodes and imposed flow on forced ignition in laminar premixed hydrogen/air mixtures with large Lewis number

Compared to quiescent premixed reactants, forced ignition of flowing/turbulent premixed reactants is expected to be more difficult because of increased dissipation of the deposited energy. However, the counterintuitive turbulence-facilitated ignition (TFI) has been observed in recent experiments for mixtures with large Lewis number, Le. The mechanisms behind TFI are still not well understood and this study aims to interpret a part of the TFI mechanisms through considering electrodes and imposed flow in the simulations of forced ignition in hydrogen/air mixtures. The imposed flow emulates the local turbulent effects around the electrodes which might blow the ignition kernel away from the electrodes. Since TFI occurs only for mixtures with large Le (e.g., lean hydrocarbon/air or rich H₂/air mixture), a fuel-rich (ϕ=5.1) H₂/air mixture with Le≈2.3 is investigated to reduce computational cost and consider more factors that may lead to TFI. Similar to TFI observed in experiments, the flow-facilitated ignition is observed for H₂/air with ϕ=5.1 and Le≈2.3 when the electrodes have a small gap distance. The detailed effects of including electrodes on forced ignition of quiescent and flowing mixtures are explored. It is found that the existence of electrodes not only induces heat loss but also affects the shape and global curvature/stretch of the ignition kernel. The heat loss to the electrodes is demonstrated to play an important role for the ignition of mixtures with large Le. Compared to quiescent mixtures, considering an imposed flow normal to the electrodes can blow the flame kernel away from the cold electrodes. Such movement of the ignition kernel can greatly reduce both the heat loss to the electrodes and flame curvature/stretch, and thereby promote the ignition in mixtures with large Le. These results help to understand the underlying mechanisms for the TFI observed in experiments.     

Extinction strain rates of premixed ammonia/hydrogen/nitrogen-air counterflow flames

Chemical energy vectors will play a crucial role in the transition of the global energy system, due to their essential advantages in storing energy in form of gaseous, liquid, or solid fuels. Ammonia (NH₃) has been identified as a highly promising candidate, as it is carbon-free, can be stored at moderate pressures, and already has a developed distribution infrastructure. As a fuel NH₃ has poor combustion properties that can be improved by the addition of hydrogen, which can be obtained energy-efficiently by partially cracking ammonia into hydrogen (H₂) and nitrogen (N₂) prior to the combustion process. The resulting NH₃/H₂/N₂ blend leads to significantly improved flame stability and resilience to strain-induced blow-out, despite similar laminar flame properties compared to equivalent methane/air flames. This study reports the first measurements of extinction strain rates, measured using the premixed twin-flame configuration in a laminar opposed jet burner, for two NH₃/H₂/N₂ blends over a range of equivalence ratios. Local strain rates are measured using particle tracking velocimetry (PTV) and are related to the inflow conditions, such that the local strain rate at the extinction point can be approximated. The results are compared with 1D-simulations using three recent kinetic mechanisms for ammonia oxidation. By relating the extinction strain rates to laminar flame properties of the unstretched flame, a comparison of the extinction behaviour of CH₄ and NH₃/H₂/N₂ blends can be made. For lean mixtures, NH₃/H₂/N₂-air flames show a significant higher extinction resistance in comparison to CH₄/air. In addition, a strong non-linear dependence between the resistance to extinction and equivalence ratio for NH₃/H₂/N₂ blends is observed.     

SIMS investigations of hydrogen interaction with a zirconium getter alloy surface

The results from secondary ion mass spectrometry (SIMS) investigations of the surface of Zr₅₀V₅₀ intermetallic getter alloy under residual and elevated partial pressures of hydrogen at different temperatures are reported.     

On the interaction of a hydrogen atom with a lithium metal surface

In this paper we adopt a molecular cluster approach to study the interaction of a hydrogen atom with a (100) surface of solid lithium metal. In this study, the spin-unrestricted Hartree-Fock equation is solved for the molecular cluster. We also solve for the potential energy surface of the LiH molecule and the Li₂ molecule. We find that the essential features of the hydrogen surface interaction can be understood in terms of the molecule two body interactions. We also find that the hydrogen atom sits below the surface of the Li metal rather than above the surface.     

Reduced modeling of Flame-Wall-Interactions of premixed isooctane-air systems including detailed transport and surface reactions

In this work, the Reaction-Diffusion Manifold (REDIM) method, a method for model reduction, is applied to a premixed isooctane-air system with Flame-Wall-Interactions (FWI). In order to provide a highly accurate reduced kinetic model, a detailed model for the diffusive processes is applied and complex boundary conditions that account for heterogeneous wall reactions are implemented.The REDIM is constructed and validated by comparing results of detailed and reduced kinetics in the system state space. The results of the reduced computations are compared with those of the detailed computations. It is shown that the reduced kinetics reproduce the results of the FWI very accurately. In particular, the difference between detailed kinetics with and without wall reactions is larger than the difference between detailed and reduced kinetics with heterogeneous wall reactions, which demonstrates the quality of the model reduction.     

The effect of hydrogen addition on flammability limit and NOx emission in ultra-lean counterflow CH4/air premixed flames

The effect of hydrogen addition to ultra lean counterflow CH₄/air premixed flames on the extinction limits and the characteristics of NO_x emission was investigated by numerical simulation. Detailed chemistry and complex thermal and transport properties were employed. The results show that the addition of hydrogen can significantly enlarge the flammable region and extend the flammability limit to lower equivalence ratios. If the equivalence ratio is kept constant, the addition of hydrogen increases the emission of NO in a flame due to the enhancement in the rate of the NNH or N₂O intermediate NO formation routes. The addition of hydrogen causes a monotonic decrease in the formation of NO₂ and N₂O, except flames near the extinction limits, where the emission of NO₂ and N₂O first increases, and then decreases with the increase in the fraction of hydrogen. Overall, hydrogen enrichment technology allows stable combustion under ultra lean conditions, resulting in significant CO₂ and NO emission reduction.     

Chemical structure of atmospheric pressure premixed laminar formic acid/hydrogen flames

The work presents an experimental and kinetic modeling study of laminar premixed formic acid [HC(O)OH]/H₂/O₂/Ar flames at different equivalence ratios (φ=0.85, 1.1 and 1.3) stabilized on a flat burner at atmospheric pressure, as well as laminar flame speed of HC(O)OH/O₂/Ar flames (φ=0.5–1.5) at 1 atm. Flame structure as well as laminar flame speed were simulated using three different detailed chemical kinetic mechanisms proposed for formic acid oxidation. The components in the fuel blends show different consumption profiles, namely, hydrogen is consumed slower than formic acid. According to kinetic analysis, the reason of the observed phenomenon is that the studied flames have hydrogen as a fuel but also as an intermediate product formed from HC(O)OH decomposition. Comparison of the measured and simulated flame structure shows that all the mechanisms satisfactorily predict the mole fraction profiles of the reactants, main products, and intermediates. It is noteworthy that the mechanisms proposed by Glarborg et al., Konnov et al. and the updated AramcoMech2.0 adequately predict the spatial variations in the mole fractions of free radicals, such as H, OH O and HO₂. However, some drawbacks of the mechanisms used were identified; in particular, they predict different concentrations of CH₂O. As for laminar flame speed simulations, the Konnov et al. mechanism predicts around two times higher values than in experiment, while the Glarborg et al. and updated AramcoMech2.0 show good agreement with the experimental data.