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Spray modelling plays a key role in engine simulations to understand fuel propagation and mixing, combustion, pollutant formation and energy efficiency. The grid dependency, need of calibration of several spray parameters, complexity associated with validation and high computational demand associated with Spray modelling are addressed with 1-dimentional SprayLet model. This work focuses on enhancing the SprayLet model approach with a dual emphasis on computational efficiency and grid independence for advanced engine simulations. Key spray characteristics, such as vapor and liquid penetration lengths, have been systematically evaluated as they play pivotal roles in understanding fuel evaporation, spray-wall interactions, and mixture formation within engines.

Worldwide, there is the demand to reduce harmful emissions from non-road vehicles to fulfill European Stage V+ and VI (2022, 2024) emission legislation. The rules require significant reductions in nitrogen oxides (NOx), methane (CH4) and formaldehyde (CH2O) emissions from non-road vehicles. Compressed natural gas (CNG) engines with appropriate exhaust aftertreatment systems such as three-way catalytic converter (TWC) can meet these regulations. An issue remains for reducing emissions during the engine cold start where the CNG engine and TWC yet do not reach their optimum operating conditions. The resulting complexity of engine and catalyst calibration can be efficiently supported by numerical models. Hence, it is required to develop accurate simulation models which can predict cold start emissions. This work presents a real-time engine model for transient engine-out emission prediction using tabulated chemistry for CNG.

Spray modeling is among the main aspects of mixture formation and combustion in internal combustion engines. It plays a major role in pollutant formation and energy efficiency although adequate modeling is still under development. Strong grid dependence is observed in the droplet-based stochastic spray model commonly used. As an alternative, an interactive model called 'SprayLet' is being developed for spray simulations based on one-dimensional integrated equations for the gas and liquid phases, resulting from cross-sectionally averaging of multi-dimensional transport equations to improve statistical convergence. The formulated one-dimensional cross-section averaged system is solved independently of the CFD program to provide source terms for mass, momentum and heat transfer between the gas and liquid phases. The transport processes take place in a given spray cone where the nozzle exit is automatically resolved.

In contrast to the currently primarily used liquid fuels (diesel and gasoline), methane (CH4) as a fuel offers a high potential for a significant reduction of greenhouse gas emissions (GHG). This advantage can only be used if tailpipe CH4 emissions are reduced to a minimum, since the GHG impact of CH4 in the atmosphere is higher than that of carbon dioxide (CO2). Three-way catalysts (TWC - stoichiometric combustion) and methane oxidation catalysts (MOC - lean combustion) can be used for post-engine CH4 oxidation. Both technologies allow for a nearly complete CH4 conversion to CO2 and water at sufficiently high exhaust temperatures (above the light-off temperature of the catalysts). However, CH4 combustion is facing a huge challenge with the planned introduction of Euro VII emissions standard, where stricter CH4 emission limits and a decrease of the cold start starting temperatures are discussed.

During cold start of natural gas engines, increased methane and formaldehyde emissions can be released due to flame quenching on cold cylinder walls, misfiring and the catalyst not being fully active at low temperatures. Euro 6 legislation does not regulate methane and formaldehyde emissions. New limits for these two pollutants have been proposed by CLOVE consortium for Euro 7 scenarios. These proposals indicate tougher requirements for aftertreatment systems of natural gas engines. In the present study, a zero-dimensional model for real-time engine-out emission prediction for transient engine cold start is presented. The model incorporates the stochastic reactor model for spark ignition engines and tabulated chemistry. The tabulated chemistry approach allows to account for the physical and chemical properties of natural gas fuels in detail by using a-priori generated laminar flame speed and combustion chemistry look-up tables.

Meeting strict current and future emissions legislation necessitates development of computational tools capable of predicting the behaviour of combustion and emissions with an accuracy sufficient to make correct design decisions while keeping computational cost of the simulations amenable for large-scale design space exploration. While detailed kinetics modelling is increasingly seen as a necessity for accurate simulations, the computational cost can be often prohibitive, prompting interest in simplified approaches allowing fast simulation of reduced mechanisms at coarse grid resolutions appropriate for internal combustion engine simulations in design context. In this study we present a simplified Well-stirred Reactor (WSR) implementation coupled with 3D CFD Ricardo VECTIS solver.

The development of future gasoline engines is dominated by the study of new technologies aimed at reducing the engine negative environmental impact and increase its thermal efficiency. One common trend is to develop smaller engines able to operate in stoichiometric conditions across the whole engine map for better efficiency, lower fuel consumption, and optimal conversion rate of the three-way catalyst (TWC). Water injection is one promising technique, as it significantly reduces the engine knock tendency and avoids fuel enrichment for exhaust temperature mitigation at high power operation. With the focus on reducing the carbon footprint of the automotive sector, another vital topic of research is the investigation of new alternative CO2-neutral fuels or so-called eFuels. Several studies have already shown how these new synthetic fuels can be produced by exploiting renewable energy sources and can significantly reduce engine emissions.

Alcohol-based fuels are a viable alternative to fossil fuels for powering vehicles. As a drop-in fuel, an oxygenated fuel blend containing the C8 alcohol 2-ethylhexanol (isomer of octanol), hydrotreated vegetable oil (HVO) and rapeseed methyl ester (RME) can reduce soot and NOx emissions whilst maintaining engine performance. However, fuel injection strategy significantly affects combustion and hence has been investigated with a view to reducing emissions whilst maintaining engine efficiency. In a single cylinder light-duty compression ignition research engine, the effect of different injection strategies (main, main/post, double pre/main, double pre/main/post injection) and EGR levels (0%, 19%) on specifically NOx, soot emissions and particle size distribution was investigated for three different fuels: fossil diesel fuel, HVO and the oxygenated blend. The blend was designed to have diesel-like combustion properties (cetane number of 52) and had an oxygen content of 5.4% by mass.

Water injection can be applied to spark ignited gasoline engines to increase the Knock Limit Spark Advance and improve the thermal efficiency. The Knock Limit Spark Advance potential of 6 °CA to 11 °CA is shown by many research groups for EN228 gasoline fuel using experimental and simulation methods. The influence of water is multi-layered since it reduces the in-cylinder temperature by vaporization and higher heat capacity of the fresh gas, it changes the chemical equilibrium in the end gas and increases the ignition delay and decreases the laminar flame speed. The aim of this work is to extend the analysis of water addition to different octane ratings. The simulation method used for the analysis consists of a detailed reaction scheme for gasoline fuels, the Quasi-Dimensional Stochastic Reactor Model and the Detonation Diagram. The detailed reaction scheme is used to create the dual fuel laminar flame speed and combustion chemistry look-up tables.

The use of complex reaction schemes is accompanied by high computational cost in 3D CFD simulations but is particularly important to predict pollutant emissions in internal combustion engine simulations. One solution to tackle this problem is to solve the chemistry prior the CFD run and store the chemistry information in look-up tables. The approach presented combines pre-tabulated progress variable-based source terms for auto-ignition as well as soot and NOx source terms for emission predictions. The method is coupled to the 3D CFD code CONVERGE v2.4 via user-coding and tested over various speed and load passenger-car Diesel engine conditions. This work includes the comparison between the combustion progress variable (CPV) model and the online chemistry solver in CONVERGE 2.4. Both models are compared by means of combustion and emission parameters. A detailed n-decane/α-methyl-naphthalene mechanism, comprising 189 species, is used for both online and tabulated chemistry simulations.

The introduction of a physics-based zero-dimensional stochastic reactor model combined with tabulated chemistry enables the simulation-supported development of future compression-ignited engines. The stochastic reactor model mimics mixture and temperature inhomogeneities induced by turbulence, direct injection and heat transfer. Thus, it is possible to improve the prediction of NOx emissions compared to common mean-value models. To reduce the number of designs to be evaluated during the simulation-based multi-objective optimization, genetic algorithms are proven to be an effective tool. Based on an initial set of designs, the algorithm aims to evolve the designs to find the best parameters for the given constraints and objectives. The extension by response surface models improves the prediction of the best possible Pareto Front, while the time of optimization is kept low.

Spray characteristics of fossil Diesel fuel, hydrotreated vegetable oil (HVO) and two oxygenated fuel blends were studied to elucidate the combustion process. The fuels were studied in an optically accessible high-pressure/high-temperature chamber under non-combusting (623 K, 4.69 MPa) and combusting (823 K, 6.04 MPa) conditions. The fuel blends contained the long-chain alcohol 2-ethylhexanol (EH), HVO and either 20 vol.% Diesel or 7 vol.% rapeseed methyl ester (RME) and were designed to have a Diesel-like cetane number (CN). Injection pressures were set to 120 MPa and 180 MPa and the gas density was held constant at 26 kg/m3. Under non-combusting conditions, shadow imaging revealed the penetration length of the liquid and vapor phase of the spray. Under combusting conditions, the lift-off length and soot volume fraction were measured by simultaneously recording time-resolved two-dimensional laser extinction, flame luminosity and OH* chemiluminescence images.

The effects of using n-butanol, n-octanol, fossil Diesel, hydrotreated vegetable oil (HVO), and blends of these fuels on spray penetration, flame and soot characteristics were investigated in a high-pressure high-temperature constant volume combustion chamber designed to mimic a heavy duty Diesel engine. Backlight illumination was used to capture liquid and vapor phase spray images with a high-speed camera. The flame lift-off length (LOL) and ignition delay were determined by analyzing OH* chemiluminescence images. Laser extinction diagnostics were used to measure the spatially and temporally resolved soot volume fraction. The spray experiments were performed by injecting fuels under non-combusting (623 K) and combusting (823 K) conditions at a fixed ambient air density of 26 kg/m3. A Scania 0.19 mm single straight hole injector and Scania XPI common rail fuel supply system were used to produce injection pressures of 120 MPa and 180 MPa.

With progressing electrification of automotive powertrains and demands to meet increasingly stringent emission regulations, a combination of an electric motor and downsized turbocharged spark-ignited engine has been recognized as a viable solution. The SI engine must be optimized, and preferentially downsized, to reduce tailpipe CO2 and other emissions. However, drives to increase BMEP (Brake Mean Effective Pressure) and compression ratio/thermal efficiency increase propensities of knocking (auto-ignition of residual unburnt charge before the propagating flame reaches it) in downsized engines. Currently, knock is mitigated by retarding the ignition timing, but this has several limitations. Another option identified in the last decade (following trials of similar technology in aircraft combustion engines) is water injection, which suppresses knocking largely by reducing local in-cylinder mixture temperatures due to its latent heat of vaporization.

Water injection is a promising technology to improve the fuel efficiency of turbocharged gasoline engines due to the possibility to suppress engine knock. Additionally, this technology is believed to enable the efficient operation of the three-way catalyst also at high-load conditions, through limiting the exhaust temperature. In this numerical study, we investigate the effect of water on the chemical and thermodynamic processes using 3D computational fluid dynamics (CFD) Reynolds-averaged Navier–Stokes (RANS) with detailed chemistry. In the first step, the influence of different amounts of water vapor on ignition delay time, laminar flame speed, and heat capacity is investigated. In the second step, the impact of water vaporization is analyzed for port and direct injection. For this purpose, the water mass flow and the injection pressure are varied.

Laws concerning emissions from heavy duty (HD) internal combustion engines are becoming increasingly stringent. New engine technologies are needed to satisfy these new requirements and to reduce fossil fuel dependency. One way to achieve both objectives can be to partially replace fossil fuels with alternatives that are sustainable with respect to emissions of greenhouse gases, particulates and nitrogen oxides (NOx). A suitable candidate is methanol. The aim of the study presented here was to investigate the possible advantages of combusting methanol in a heavy duty Diesel engine. Those are, among others, lower particulate emissions and thereby bypassing the NOx-soot trade-off. Because of methanol’s poor auto-ignition properties, Diesel was used as an igniting sources and both fuels were separately direct injected. Therefore, two separate standard common rail Diesel injection systems were used together with a newly designed cylinder head and adapted injection nozzles.

Reducing emissions and improving efficiency are major goals of modern internal combustion engine research. The use of biomass-derived fuels in Diesel engines is an effective way of reducing well-to-wheels (WTW) greenhouse gas (GHG) emissions. Moreover, partially premixed combustion (PPC) makes it possible to achieve very efficient combustion with low emissions of soot and NOx. The objective of this study was to investigate the effect of using alcohol/Diesel blends or neat alcohols on emissions and thermal efficiency during PPC. Four alcohols were evaluated: n-butanol, isobutanol, n-octanol, and 2-ethylhexanol. The alcohols were blended with fossil Diesel fuel to produce mixtures with low cetane numbers (26-36) suitable for PPC. The blends were then tested in a single cylinder light duty (LD) engine. To optimize combustion, the exhaust gas recirculation (EGR) level, lambda, and injection strategy were tuned.

Today numerical models are a major part of the diesel engine development. They are applied during several stages of the development process to perform extensive parameter studies and to investigate flow and combustion phenomena in detail. The models are divided by complexity and computational costs since one has to decide what the best choice for the task is. 0D models are suitable for problems with large parameter spaces and multiple operating points, e.g. engine map simulation and parameter sweeps. Therefore, it is necessary to incorporate physical models to improve the predictive capability of these models. This work focuses on turbulence and mixing modeling within a 0D direct injection stochastic reactor model. The model is based on a probability density function approach and incorporates submodels for direct fuel injection, vaporization, heat transfer, turbulent mixing and detailed chemistry.

Engine knock is an important phenomenon that needs consideration in the development of gasoline fueled engines. In our days, this development is supported by the use of numerical simulation tools to further understand and subsequently predict in-cylinder processes. In this work, a model tool chain based on detailed chemical and physical models is proposed to predict the auto-ignition behavior of fuels with different octane ratings and to evaluate the transition from harmless auto-ignitive deflagration to knocking combustion. In our method, the auto-ignition and emissions are calculated based on a new reaction scheme for mixtures of iso-octane, n-heptane, toluene and ethanol (Ethanol consisting Toluene Reference Fuel, ETRF). The reaction scheme is validated for a wide range of mixtures and every desired mixture of the four fuel components can be applied in the engine simulation.

Laws concerning to emissions from heavy duty (HD) internal combustion engines are becoming increasingly stringent. New engine technologies are therefore needed to satisfy these new legal requirements and reduce fossil fuel dependency. One way to achieve both objectives is to partially replace fossil fuels with alternatives that are more sustainable with respect to emissions of greenhouse gas, particulates and NOx. As a first step towards the development of a direct injected dual fuel engine using diesel fuel and renewable alcohols such as methanol or ethanol, we have studied ethanol (E100) sprays generated with a standard high pressure diesel fuel injection system in a high pressure/temperature spray chamber with optical access. The experiments were performed at a gas density of ∼27kg/m3 at ∼550 °C and ∼60 bar, representing typical operating conditions for a HD engine at low loads.