Applying machine learning techniques to predict laminar burning velocity for ammonia/hydrogen/air mixtures

Ammonia utilisation in internal combustion engines has attracted wide interest due to the current trend toward decarbonisation,as ammonia is a zero-carbon fuel with different combustion properties to hydrocarbons.The laminar burning velocity(LBV)is a fundamental property of fuels with a significant effect on the combustion processes and accurate calculations and measurements of the LBV over a wide range of fuel blends,pressures and flow conditions is a time-consuming,complicated procedure.The main goal of the current study is to predict the LBV of NH_(3)/H_(2)/air mixtures using a hybrid machine learning(ML)approach based on a training dataset consisting of both the experimental LBV values and additional data obtained from numerical simulations with a detailed kinetic model.Initial ML model training data is collected from existing experimental LBV in the literature for NH_(3)/H_(2)/air mixtures.Then,synthetic data is generated using one-dimensional(1D)simulations to reduce data inhomogeneity and increase accuracy of the ML model.In total,24 different ML algorithms are tested to find the best model both for the experimental and the hybrid dataset.The results suggest that both Gaussian Process Regression(GPR)and Neural Networks(NNs)can be utilised to predict LBV of NH_(3)/H_(2)/air mixtures with reasonable accuracy.The hybrid ML model achieved a coefficient of determination of R^(2)=0.998.Finally,hybrid ML model hyperparameters are optimised to achieve a coefficient of determination of R^(2)=0.999.It was also found that ML can speed up LBV computation from 9500 to 27000 times compared to 1D simulations with a reduced mechanism.

Temperature Dependence of Laminar Burning Velocity in Ammonia/Dimethyl Ether-air Premixed Flames

The combustion of ammonia(NH3)has attracted wide interest in fuel vehicle engines,marine engines,and power generators to mitigate carbon dioxide emissions.Unfortunately,the relatively low laminar flame speed presents a technical barrier for this renewable fuel to be used in practice.This work is concerned with numerical examining the effects of elevating inlet temperature on the laminar burning velocity of NH3/air flames with various contents of dimethyl ether(DME)using ID freely propagating flame calculations,and to shed light on the flame enhancement mechanism.For this,the mechanism is first validated by comparing the numerical predictions with experimental data.Results show that increasing the inlet temperature has a positive effect on the laminar burning velocity of pure NH3/DME/air flames.It is revealed that elevating inlet temperature contributes to a higher adiabatic flame temperature,which is beneficial to the overall chemical reaction rate.Furthermore,the thermal diffusivity of the binary mixture is observed to increase substantially as well.Further kinetic and sensitivities analyses reveal that the inlet temperature has a minimal effect on the reaction pathway,leading to the relative importance of the dominant chain branching over terminating reaction steps to be varied negligibly.The present work confirms that the flame speed enhancement with increasing inlet temperature is primarily the synergetic result of the thermal and diffusion effects,rather than the chemical effect.

Effect of CO_(2) dilution on laminar burning velocities,combustion characteristics and NO_(x) emissions of CH_(4)/air mixtures

The laminar combustion characteristics of CH_(4)/air premixed flames with CO_(2) addition are systemically studied.Experimental measurements and numerical simulations of the laminar burning velocity(LBV)are performed in CH_(4)/CO_(2)/Air flames with various CO_(2) doping ratio under equivalence ratios of 1.0–1.4.GRI 3.0 mech and Aramco mech are employed for predicting LBV,adiabatic flame temperature(AFT),important intermediate radicals(CH_(3),H,OH,O)and NO_(x) emissions(NO,NO_(2),N2O),as well as the sensitivity analysis is also conducted.The detail analysis of experiment and simulation reveals that as the CO_(2) addition increases from 0%to 40%,the LBVs and AFTs decrease monotonously.Under the same CO_(2) doping ratio,the LBVs and AFTs increase first and then decrease with the increase of equivalence ratio,and the maximum of LBV is reached at equivalence ratio of 1.05.The mole fraction tendency of important intermediates and NO_(x) with equivalence ratio and CO_(2) doping ratio are similar to the LBVs and AFTs.Reaction H+O_(2)⇔O+OH is found to be responsible for the promotion of the generation of important intermediates and NO_(x) under the equivalence ratios and CO_(2) addition through sensitivity analysis.The sensitivity coefficients of elementary reactions that the increasing of CO_(2) doping ratio promotes or inhibits formation of intermediate radicals and NO_(x) decreases.

Measurement of laminar burning velocities and Markstein lengths near rich propane/air flammability limits under microgravity conditions

A small cubic closed vessel with schlieren measurement technique combined with high-speed video camera were used to study limit flame properties under microgravity conditions at atmospheric pressure and room temperature.The rich flammability limit of C3H8/air was determined to be 9.2% C3H8.Stretched flame propagation speeds,stretched laminar burning velocities and unstretched laminar burning velocities near rich C3H8/air flammability limits were measured at different equivalence ratios.Outwardly propagating spherical flames were used to study the sensitivities of the flame propagation speeds and laminar burning velocities to flame stretch using Markstein lengths.Unstretched laminar burning velocity at rich flammability limit was determined to be 1.09cm/s.Lewis numbers were less than unity in rich C3H8/air and negative Markstein lengths were concluded.Absolute values of Markstein lengths were found to decrease linearly with equivalence ratios increase.

Study on the Enhancement Effect of Dielectric Barrier Discharge on the Premixed Methane/Oxygen/Helium Flame Velocity

Recently,plasma-assisted combustion has become a potentially applicable technology in many combustion scenarios.In this paper,a dielectric barrier discharge（DBD） plasma generator is designed to explore the effect of plasma on the CH4 oxidation process,and several properties of combustion are considered.First,in the presence or absence of plasma discharge,physical appearance of the flame is examined and analyzed.Second,the flame propagation velocity is calculated by the flame front extracted from the imaging data with the Bunsen burner method.Finally,the main molecular components and their intensity variation in the flame and the plasma zones are identified with an emission spectrograph to analyze the effect of active species on the combustion process.We also discuss the possible kinetic regime of plasma-assisted combustion.Experimental results imply that plasma discharge applied to the premixed CH_4/O_2/He mixture significantly raises the flame speed with equivalence ratios ranging from 0.85 to 1.10,with the flame speed improved by 17%to 35%.It can be seen that plasma can improve methane oxidation efficiency in the premixed fuel/oxidizer,especially at a low equivalence ratio.

Physical and chemical effects of phosphorus-containing compounds on laminar premixed flame

Phosphorus-containing compounds are the promising halon alternatives for flame inhibitions. However, some literatures suggested that the phosphorus-related inhibitors may behave as the unfavorable ones that will increase the burning velocity under lean-burn conditions, and this indeed posed potential threats to the fire prevention and fighting. To seek deeper insights into the reaction process, a numerical investigation was actualized to study the phosphorus-related effects on methane-air flames. By replacing a phosphorus-related inhibitor with the corresponding decomposed molecules, the detailed promoting and inhibiting effects of combustion were separated from the general chemical effect. A comparative study was carried out to identify the interaction between the two effects under different combustion conditions. It is observed that the promoting effect becomes the dominant factor during the reaction process when the equivalence ratio is smaller than 0.60. In this lean-burn condition, the exothermic reactions were faster than the others within the reaction chains due to the reduction of radical recombination in hydrocarbon oxidation. The results are believed to be useful for the further application and improvement of flame inhibitors.

Investigation over the recirculation influence on the combustion of micro organic dust particles

This paper investigates the role of recircnlation and non-unity Lewis number on the combustion of organic dust particles. Since recirculation effect is more noticeable in micro-combustors, it is necessary to propose a modeling approach of this phenomenon to better simulate the performance of micro-combustors. In this research, in order to model the combustion of organic dust particles, it is assumed that the dust particles va- porize first to yield a known chemical structure which is oxidized in the gas phase, and the chemical structure of this gaseous fuel is assumed methane. To study the flame structure and solve the governing equations, it is considered that the flame structure consists of three zones titled the preheat-vaporization zone, the narrow reaction zone and finally the post flame zone. The recirculation phenomenon is evaluated by entering the exhausted heat from the post flame zone into the preheat zone. The solution is based on the follow- ing approach. First, the governing equations in each zone are nondimensionalized. Then the needed boundary and matching conditions are applied in each zone. After that, these equations and the required boundary and matching conditions are simultaneously solved with the analytical model. Consequently, the remarkable effects of recirculation and non- unity Lewis number on the combustion characteristics of the organic dust particles such as burning velocity and temperature profiles for different particle radii are obtained. The results show reasonable agreement with published experimental data.

Measurements of Laminar Burning Velocities of Alternative Fuels:Application in Transport and Aerospace

The laminar burning velocity belongs to the fundamental combustion properties of fuels being a measure for their heat release,flame length,as well as reactivity and combustion stability,and thus,may impact the design of burners and combustion chambers.Also,these experimental data are needed for the validation and optimization within the construction and development of detailed chemical kinetic reaction mechanisms.Within this study,an overview of the different applications of fuel characterization regarding the specific area of interest(road transport,aviation,and aerospace)will be given.Depending on the application,effects of different molecular characteristics on the laminar burning velocity are evaluated:the presence of oxygen atoms and the grade of branching in a specific fuel molecule as well as the difference in the type of a chemical bond,here,single and double bonds.Examples of alternative fuels being discussed in the present study are:(Ⅰ)oxymethylene ether(OMEn)in the field of road transport;(Ⅱ)a paraffinic Alcohol-to-Jet fuel as sustainable aviation fuel;and(Ⅲ)mixtures of ethane or ethene with nitrous oxide as green propellants for rocket propulsion applications.