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The internal combustion engine (ICE) has long dominated the heavy-duty sector by using liquid fossil fuels such as diesel but global commitments by countries and OEMs to reduce lifecycle carbon dioxide (CO2) emissions has garnered interest in alternative fuels like hydrogen. Hydrogen is a unique gaseous fuel that contains zero carbon atoms and has desired thermodynamic properties of high energy density per unit mass and high flame speeds. However, there are challenges related to its adoption to the heavy-duty sector as a drop-in fuel replacement for compression ignition (CI) diesel combustion given its high autoignition resistance. To overcome this fundamental barrier, engine manufacturers are exploring dual fuel combustion engines by substituting a fraction of the diesel fuel with hydrogen which enables fuel flexibility when there is no infrastructure and retrofittability to existing platforms.

Gasoline compression ignition (GCI) has been shown to offer benefits in the NOx-soot tradeoff over conventional diesel combustion while still achieving high fuel efficiency. However, due to gasoline’s low reactivity, it is challenging for GCI to attain robust ignition and stable combustion under cold operating conditions. Building on previous work to evaluate glow plug-assisted GCI combustion at cold idle, this work evaluates the use of a spark plug to assist combustion. The closed-cycle 3-D CFD model was validated against GCI test results at a compression ratio of 17.3 during extended cold idle operation under laboratory-controlled conditions. A market representative, ethanol-free, gasoline (RON92, E0) was used in both the experiment and the numerical analysis. Spark-assisted simulations were performed by incorporating an ignition model with the spark energy required for stable combustion at cold start.

Achieving robust ignitability for compression ignition of diesel engines at cold conditions is traditionally challenging due to insufficient fuel vaporization, heavy wall impingement, and thick wall films. Gasoline compression ignition (GCI) has shown the potential to offer an enhanced NOx-particulate matter tradeoff with diesel-like fuel efficiency, but it is unknown how the volatility and reactivity of the fuel will affect ignition under very cold conditions. Therefore, it is important to investigate the impact of fuel physical and chemical properties on ignition under pressures and temperatures relevant to practical engine operating conditions during cold weather. In this paper, 0-D and 3-D computational fluid dynamics (CFD) simulations of GCI combustion at cold conditions were performed.

Fuel stratification effects on the combustion and emissions behaviors for partially premixed compression ignition (PPCI) combustion of a high reactivity gasoline (research octane number of 80) was investigated using the third generation Gasoline Direct-Injection Compression Ignition (Gen3 GDCI) multi-cylinder engine. The PPCI combustion mode was achieved through a double injection strategy. The extent of in-cylinder fuel stratification was tailored by varying the start of second fuel injection timing (SOIsecond) while the first fuel injection event was held constant and occurred during the intake stroke. Based on the experimental results, three combustion characteristic zones were identified in terms of the SOIsecond - CA50 (crank angle at 50% cumulative heat release) relationship: (I) no response zone (HCCI-like combustion); (II) negative CA50 slope zone: (early PPCI mode); and (III) positive CA50 slope zone (late PPCI mode).

Combustion cycle-to-cycle variation (CCV) of Spark-Ignition (SI) engines can be influenced by the cyclic variations in charge motion, trapped mass and mixture composition inside the cylinder. A high CCV leads to misfire or knock, limiting the engine’s operating regime. To understand the mechanism of the effect of flow field and mixture compositions on CCV, the present numerical work was performed in a single cylinder Direct Injection Spark-Ignition (DISI) engine. A large eddy simulation (LES) approach coupled with the G-equation combustion model was developed to capture the CCV by accurately resolving the turbulent flow field spatially and temporally. Further, the ignition process was modeled by sourcing energy during the breakdown and arc phases with a line-shape ignition model which could move with the local flow. Detailed chemistry was solved both inside and outside the flame front. A compact 48-species 152-reactions primary reference fuel (PRF) reduced mechanism was used.

A computational fluid dynamics (CFD) guided combustion system optimization was conducted for a heavy-duty compression-ignition engine with a gasoline-like fuel that has an anti-knock index (AKI) of 58. The primary goal was to design an optimized combustion system utilizing the high volatility and low sooting tendency of the fuel for improved fuel efficiency with minimal hardware modifications to the engine. The CFD model predictions were first validated against experimental results generated using the stock engine hardware. A comprehensive design of experiments (DoE) study was performed at different operating conditions on a world-leading supercomputer, MIRA at Argonne National Laboratory, to accelerate the development of an optimized fuel-efficiency focused design while maintaining the engine-out NOx and soot emissions levels of the baseline production engine.

Modeling unsteady turbulent flame development in lifted spray flames is important as a strong correlation exists between pollutant formation and the transient flame features such as auto-ignition, flame propagation and flame stabilization. Detailed chemistry mechanisms with large number of species are required to resolve the chemical kinetics accurately. These factors make high-fidelity simulation of engine combustion computationally expensive. In this work, a turbulent combustion model is proposed based on tabulation of flamelets. The aim is to develop a comprehensive combustion modeling approach incorporating detailed chemistry mechanisms, turbulence models and highly resolved grids leveraging the computational cost advantage of tabulation. A novel technique of implementing unsteady flamelet libraries without the use of progress variables is implemented for igniting sprays called Tabulated Flamelet Model (TFM).

The basic idea behind large-eddy simulation (LES) is to accurately resolve the large energy-containing scales and to use subgrid-scale (SGS) models for the smaller scales. The accuracy of LES can be significantly impacted by the numerical discretization schemes and the choice of the SGS model. This work investigates the accuracy of low-order LES codes in the simulation of a turbulent round jet which is representative of fuel jets in engines. The turbulent jet studied is isothermal with a Reynolds number of 6800. It is simulated using Converge, which is second-order accurate in space and first-order in time, and FLEDS, developed at Purdue University, which is sixth-order accurate in space and fourth-order in time. The high-order code requires the resolution of acoustic time-scales and hence is approximately 10 times more expensive than the low-order code.

In this work, a turbulent combustion model is developed for large eddy simulation (LES) using a novel flamelet tabulation technique based on the framework of the multi-flamelet representative interactive flamelet (RIF) model. The overall aim is to develop a detailed model with elaborate chemistry mechanisms, LES turbulence models and highly resolved grids leveraging the computational cost advantage of a tabulated model. A novel technique of implementing unsteady flamelet libraries by using the residence time instead of the progress variables is proposed. In this study, LES of n-dodecane spray flame is performed using the tabulated turbulent combustion model along with a dynamic structure subgrid model. A high-resolution mesh is employed with a cell size of 62.5 microns in the entire spray and combustion regions. This model is then validated against igniting n-dodecane sprays under diesel engine conditions.

The primary strength of large eddy simulation (LES) is in directly resolving the instantaneous large-scale flow features which can then be used to study critical flame properties such as ignition, extinction, flame propagation and lift-off. However, validation of the LES results with experimental or direct numerical simulation (DNS) datasets requires the determination of statistically-averaged quantities. This is typically done by performing multiple realizations of LES and performing a statistical averaging among this sample. In this study, LES of n-dodecane spray flame is performed using a well-mixed turbulent combustion model along with a dynamic structure subgrid model. A high-resolution mesh is employed with a cell size of 62.5 microns in the entire spray and combustion regions. The computational cost of each calculation was in the order of 3 weeks on 200 processors with a peak cell count of about 22 million at 1 ms.

Accurate modeling of the transient structure of reacting diesel jets is important as transient features like autoignition, flame propagation, and flame stabilization have been shown to correlate with combustion efficiency and pollutant formation. In this work, results from Reynolds-averaged Navier-Stokes (RANS) simulations of flame lift-off in diesel jets are examined to provide insight into the lift-off physics. The large eddy simulation (LES) technique is also used to computationally model a lifted jet flame at conditions representative of those encountered in diesel engines. An unsteady flamelet progress variable (UFPV) model is used as the turbulent combustion model in both RANS simulations and LES. In the model, a look-up table of reaction source terms is generated as a function of mixture fraction Z, stoichiometric scalar dissipation rate Xst, and progress variable Cst by solving the unsteady flamelet equations.