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The subject of this work is 3D numerical simulations of combustion and soot emissions for a passenger car diesel engine. The CFD code STAR-CD version 3.26 [1] is used to resolve the flowfield. Soot is modeled using a detailed kinetic soot model described by Mauss [2]. The model includes a detailed description of the formation of polyaromatic hydrocarbons. The coupling between the turbulent flowfield and the soot model is achieved through a flamelet library approach, with transport of the moments of the soot particle size distribution function as outlined by Wenzel et al. [3]. In this work we extended this approach by considering acetylene feedback between the soot model and the combustion model. The model was further improved by using new gas-phase kinetics and new fitting procedures for the flamelet soot library.

The high-pressure isobaric combustion has been proposed as the most suitable combustion mode for the double compre4ssion expansion engine (DCEE) concept. Previous experimental and simulation studies have demonstrated an improved efficiency compared to the conventional diesel combustion (CDC) engine. In the current study, isobaric combustion was achieved using a single injector with multiple injections. Since this concept involves complex phenomena such as spray to spray interactions, the computational models were extensively validated against the optical engine experiment data, to ensure high-fidelity simulations. The considered optical diagnostic techniques are Mie-scattering, fuel tracer planar laser-induced fluorescence (PLIF), and natural flame luminosity imaging. Overall, a good agreement between the numerical and experimental results was obtained.

Water transport at high current densities is of main concern for polymer electrolyte membrane (PEM) fuel cells. The water content of the membrane must be high enough to provide maximum electrical conductivity and thus optimal stack performance. Dry-out may also lead to membrane degradation. However, a too high level of humidity leads to cell flooding, blocking the air and fuel flows to the catalyst sites and thus the reactions, resulting in a drop-in efficiency. Fuel cells water transport physics requires further investigation due to its complexity [1,2] and numerical modelling can improve the fundamental understanding of the phenomena. In this work, a 3D comprehensive model for fuel cells is presented. The PEM fuel cell is modelled in Siemens Simcenter STAR-CCM+ [3]. Anode and cathode GDL are modelled as porous media, with electrochemical reactions calculated in an infinitely thin catalyst layer.

The focus of this study is to aid the development of the isobaric combustion engine by investigating multiple injection strategies at moderately high pressures. A three-dimensional (3D) commercial computational fluid dynamics (CFD) code, CONVERGE, was used to conduct simulations. The validation of the isobaric combustion case was carried out through the use of a single injector with multiple injections. The computational simulations were matched to the experimental data using methods outlined in this paper for different multiple injection cases. A sensitivity analysis to understand the effects of different modeling components on the quantitative prediction was carried out. First, the effects of the kinetic mechanisms were assessed by employing different chemical mechanisms, and the results showed no significant difference in the conditions under consideration.

Towards a fundamental understanding of the ignition characteristics of pre-chamber (PC) combustion engines, computational fluid dynamics (CFD) simulations were conducted using CONVERGE. To assist the initial design of the KAUST pre-chamber engine experiments, the primary focus of the present study was to assess the impact of design parameters such as throat diameter, nozzle diameter, and nozzle length. The well-stirred reactor combustion model coupled with a methane oxidation mechanism reduced from GRI 3.0 was used. A homogeneous charge of methane and air with λ = 1.3 on both the PC and main chamber (MC) was assumed. The geometrical parameters were shown to affect the pre-chamber combustion characteristics, such as pressure build-up, radical formation, and heat release as well as the composition of the jets penetrating and igniting the main chamber charge. In addition, the backflow of species pushed inside the pre-chamber due to the flow reversal (FR) event was analyzed.

To provide insights into the fundamental characteristics of pre-chamber combustion engines, the ignition of lean premixed CH4/air due to hot gas jets initiated by a passive narrow throated pre-chamber in a heavy-duty engine was studied computationally. A twelve-hole pre-chamber geometry was investigated using CONVERGETM software. The numerical model was validated against the experimental results. To elucidate the main-chamber ignition mechanism, the spark plug location and spark timing were varied, resulting in different pressure gradient during turbulent jet formation. Different ignition mechanisms were observed for turbulent jet ignition of lean premixed CH4/air, based on the geometry effect. Ignition behavior was classified into the flame and jet ignition depending on the significant presence of hot active radicals. The jet ignition, mainly due to hot product gases was found to be advanced by the addition of a small concentration of radicals.

The present paper shows the validation of a self tuning heat release method with no need to model heat losses, crevice losses and blow by. Using the pressure and volume traces the method estimates the polytropic exponents (before, during and after the combustion event), by the use of the emission values and amount of fuel injected per cycle the algorithm calculates the total heat release. These four inputs are subsequently used for computing the heat release trace. The result is a user independent algorithm which results in more objective comparisons among operating points and different engines. In the present paper the heat release calculated with this novel method has been compared with the one computed using the Woschni correlation for modeling the heat transfer. The comparison has been made using different fuels (PRF0, PRF80, ethanol and iso-octane) making sweeps in relative air-fuel ratio, engine speed, EGR and CA 50.

In the study presented in this paper, experimental data from a pneumatic hybrid has been compared to the results from a simulation of the engine in GT-Power. The engine in question is a single-cylinder Scania D12 diesel engine, which has been converted to work as a pneumatic hybrid. The base engine model, provided by Scania, is made in GT-Power and it is based on the same engine configuration as the one used during real engine testing. During pneumatic hybrid operation the engine can be used as a 2-stroke compressor for generation of compressed air during vehicle deceleration and during vehicle acceleration the engine can be operated as a 2-stroke air-motor driven by the previously stored pressurized air. There is also a possibility to use the stored pressurized air in order to supercharge the engine when there is a need for high torque, like for instance at take off after a standstill or during an overtake maneuver.

The paper describes a novel method for calculating the residual gas fraction and the trapping efficiency in a 2 stroke engine. Assuming one dimensional compressible flow through the inlet and exhaust ports, the method estimates the instantaneous mass flowing in and out from the combustion chamber; later the residual gas fraction and trapping efficiency are estimated combining together the perfect displacement and perfect mixing scavenging models. It is assumed that when the intake port opens, the fresh mixture is pushing out the burned charge without any mixing and after a multiple of the time needed for the largest eddy to perform one rotation, the two gasses are instantly mixed up together and expelled. The result is a very simple algorithm that does not require much computational time and is able to estimate with high level of precision the trapping efficiency and the residual gas fraction in 2 stroke engines.

In the study presented in this paper, a vehicle driving cycle simulation of the pneumatic hybrid has been conducted. The pneumatic hybrid powertrain has been modeled in GT-Power and validated against experimental data. The GT-Power engine model has been linked with a MATLAB/simulink vehicle model. The engine in question is a single-cylinder Scania D12 diesel engine, which has been converted to work as a pneumatic hybrid. The base engine model, provided by Scania, is made in GT-power and it is based on the same engine configuration as the one used in real engine testing. During pneumatic hybrid operation the engine can be used as a 2-stroke compressor for generation of compressed air during vehicle deceleration and during vehicle acceleration the engine can be operated as a 2-stroke air-motor driven by the previously stored pressurized air.

In-cylinder flow measurements, conventional swirl measurements and CFD-simulations have been performed and then compared. The engine studied is a single cylinder version of a Scania D12 that represents a modern heavy-duty truck size engine. Bowditch type optical access and flat piston is used. The cylinder head was also measured in a steady-flow impulse torque swirl meter. From the two-dimensional flow-field, which was measured in the interval from -200° ATDC to 65° ATDC at two different positions from the cylinder head, calculations of the vorticity, turbulence and swirl were made. A maximum in swirl occurs at about 50° before TDC while the maximum vorticity and turbulence occurs somewhat later during the compression stroke. The swirl centre is also seen moving around and it does not coincide with the geometrical centre of the cylinder. The simulated flow-field shows similar behaviour as that seen in the measurements.

An experimental and computational study of the near-wall combustion in a Homogeneous Charge Compression Ignition (HCCI) engine has been conducted by applying laser based diagnostic techniques in combination with numerical modeling. Our major intent was to characterize the combustion in the velocity- and thermal boundary layers. The progress of the combustion was studied by using fuel tracer LIF, the result of which was compared with LDA measurements of the velocity boundary layer along with numerical simulations of the reacting boundary layer. Time resolved images of the PLIF signal were taken and ensemble averaged images were calculated. In the fuel tracer LIF experiments, acetone was seeded into the fuel as a tracer. It is clear from the experiments that a proper set of backgrounds and laser profiles are necessary to resolve the near-wall concentration profiles, even at a qualitative level.

Natural gas quality, in terms of the volume fraction of higher hydrocarbons, strongly affects the auto-ignition characteristics of the air-fuel mixture, the engine performance and its controllability. The influence of natural gas composition on engine operation has been investigated both experimentally and through chemical kinetic based cycle simulation. A range of two component gas mixtures has been tested with methane as the base fuel. The equivalence ratio (0.3), the compression ratio (19.8), and the engine speed (1000 rpm) were held constant in order to isolate the impact of fuel autoignition chemistry. For each fuel mixture, the start of combustion was phased near top dead center (TDC) and then the inlet mixture temperature was reduced. These experimental results have been utilized as a source of data for the validation of a chemical kinetic based full-cycle simulation.

This paper focuses on the performance and efficiency of an HCCI (Homogenous Charge Compression Ignition) engine system running on natural gas or landfill gas for stationary applications. Zero dimensional modeling and simulation of the engine, turbo, inlet and exhaust manifolds and inlet air conditioner (intercooler/heater) are used to study the effect of compression ratio and exhaust turbine size on maximum mean effective pressure and efficiency. The extended Zeldovich mechanism is used to estimate NO-formation in order to determine operation limits. Detailed chemical kinetics is used to predict ignition timing. Simulation of the in-cylinder process gives a minimum λ-value of 2.4 for natural gas, regardless of compression ratio. This is restricted by the NO formation for richer mixtures. Lower compression ratios allow higher inlet pressure and hence higher load, but it also reduces indicated efficiency.

The present study uses a numerical model to investigate the effects of flow turbulence on premixed iso-octane HCCI engine combustion. Different levels of in-cylinder turbulence are generated by using different piston geometries, namely a disc-shape versus a square-shape bowl. The numerical model is based on the KIVA code which is modified to use CHEMKIN as the chemistry solver. A detailed reaction mechanism is used to simulate the fuel chemistry. It is found that turbulence has significant effects on HCCI combustion. In the current engine setup, the main effect of turbulence is to affect the wall heat transfer, and hence to change the mixture temperature which, in turn, influences the ignition timing and combustion duration. The model also predicts that the combustion duration in the square bowl case is longer than that in the disc piston case which agrees with the measurements.

Full cycle simulations of KAUST optical diesel engine were conducted in order to provide insights into the details of fuel spray, mixing, and combustion characteristics at different start of injection (SOI) conditions. Although optical diagnostics provide valuable information, the high fidelity simulations with matched parametric conditions improve fundamental understanding of relevant physical and chemical processes by accessing additional observables such as the local mixture distribution, intermediate species concentrations, and detailed chemical reaction rates. Commercial software, CONVERGE™, was used as the main simulation tool, with the Reynolds averaged Navier-Stokes (RANS) turbulence model and the multi-zone (SAGE) combustion model to compute the chemical reaction terms. SOI is varied from late compression ignition (CI) to early partially premixed combustion (PPC) conditions.

This article presents a study related to application of pre-chamber ignition system in heavy duty natural gas engine which, as previously shown by the authors, can extend the limit of fuel-lean combustion and hence improve fuel efficiency and reduce emissions. A previous study about the effect of pre-chamber volume and nozzle diameter on a single cylinder 2 liter truck-size engine resulted in recommendations for optimal pre-chamber geometry settings. The current study is to determine the dependency of those settings on the engine size. For this study, experiments are performed on a single cylinder 9 liter large bore marine engine with similar pre-chamber geometry and a test matrix of similar and scaled pre-chamber volume and nozzle diameter settings. The effect of these variations on main chamber ignition and the following combustion is studied to understand the scalability aspects of pre-chamber ignition. Indicated efficiency and engine-out emission data is also presented.

Partially Premixed Combustion (PPC) engines have demonstrated a potential for high efficiency and low emissions operation. To be able to study the combustion in detail but also to perform parametric studies on the potential of the PPC concept a one dimensional (1D) engine simulation tool was used with 1; a prescribed burn rate 2; predictive combustion tool with reduced chemical model and 3; predictive combustion tool with detailed chemical models. Results indicate that fast executing reduced chemistry work reasonably well in predicting PPC performance and that n-decane is possibly a suitable diesel substitute in PPC modeling while n-heptane is not.

The experimental in-cylinder combustion process was compared with the numerical simualtion for naphtha fuel under conventional compression ignition (CI) and partially premixed combustion (PPC) conditions. The start of injection timing (SOI) with the single injection strategy was changed from late of −10 CAD aTDC to early of −40 CAD aTDC. The three-dimensional full cycle engine combustion simulation was performed coupling with gas phase chemical kinetics by the CFD code CONVERGE™. The flame index was used for evaluating the combustion evolution of premixed flame and diffusion flame. The results show that the flame index could be used as an indicator for in-cylinder homogeneity evaluation. Hydroperoxyl shows a similar distribution with the premixed combustion. Formaldehyde could be used as an indicator for low temperature combustion.

This paper reports on a fast predictive combustion tool employing detailed chemistry. The model is a stochastic reactor based, discretised probability density function model, without spatial resolution. Employing detailed chemistry has the potential of predicting emissions, but generally results in very high CPU costs. Here it is shown that CPU times of a couple of minutes per cycle can be reached when applying detailed chemistry, and CPU times below 10 seconds per cycle can be reached when using reduced chemistry while still catching in-cylinder in-homogeneities. This makes the tool usable for efficient engine performance mapping and optimisation. To meet CPU time requirements, automatically load balancing parallelisation was included in the model. This allowed for an almost linear CPU speed-up with number of cores available.