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Internal combustion engines are becoming ever more efficient as mankind seeks to mitigate the effects of climate change while still maintaining the benefits that a mechanized society has brought to the global economy. As peak values, mass production spark-ignition engines can now achieve approximately 40% brake thermal efficiency and heavy-duty truck compression-ignition engines can approach 50%. While commendable, the unfortunate truth is that the remainder gets emitted as waste heat and is sent to the atmosphere to no useful purpose. Clearly, if one could recover some of this waste heat for beneficial use then this is likely to become important as new means of mitigating fossil CO2 emissions are demanded. A previous study by the authors has identified that the closed Joule cycle (or complications of it beginning to approximate the closed Ericsson cycle) could reasonably be developed to provide a practical means of recovering exhaust heat when applied to a large ship engine.

Hydrogen is anticipated to play a pivotal role as a green energy carrier in both heavy industry and transportation. Utilizing hydrogen directly in internal combustion engines (ICE) could offer several advantages compared to alternative technologies. To achieve this objective, a proper understanding of the physical mechanisms and dynamics involved in the injection of this fuel is needed. This study applied high-fidelity computational fluid dynamics (CFD) simulations to describe the flow characteristics of hydrogen injection using hollow- and single- and multi-solid-cone injectors and their effect on mixing quality and characteristics in a constant volume quiescent environment. A reference hollow-cone configuration was used to validate the model. The results indicate that solid-cone configurations achieve greater penetration due to the flow patterns they generate. However, an increase in the number of holes leads to reduced penetration length, projected area, and induced turbulence.

The urgent need to combat global warming has spurred legislative efforts within the transport sector to transition away from fossil fuels. Hydrogen is increasingly being utilised as a green energy vector, which can aid the decarbonisation of transport, including internal combustion engines. Computational fluid dynamics (CFD) is widely used as a tool to study and optimise combustion systems especially in combination with new fuels like hydrogen. Since the behaviour of the injection event significantly impacts combustion and emissions formation especially in direct injection applications, the accurate modelling of H2 injection is imperative for effective design of hydrogen combustion systems. This work aims to evaluate unsteady Reynolds-Averaged Navier Stokes (URANS) modelling of the advective transport process and related numerical methods.

The EcoCAR Mobility Challenge (EMC) is the latest edition of the Advanced Vehicle Technology Competition (AVTC) series sponsored by the US Department of Energy. This competition challenges 11 North American universities to redesign a stock 2019 Chevrolet Blazer into an energy-efficient, SAE level 2-autonomous mild hybrid electric vehicle (mHEV) for use in the Mobility as a Service (MaaS) market. The Mississippi State University (MSU) team designed a P4 electric powertrain with an 85kW (113.99 HP) permanent magnet synchronous machine (PMSM) powered by a custom 5.4 kWh lithium-ion energy storage system. To maximize energy efficiency, Model Based Design concepts were leveraged to optimize the overall gear ratio for the P4 system. To accommodate this optimized ratio in the stock vehicle, a custom offset gearbox was designed that links the PMSM to the rear drive module.

Compared to conventional diesel combustion (CDC), isobaric combustion can achieve higher thermal efficiency while lowering heat transfer losses and nitrogen oxides (NOx). However, isobaric combustion suffers from higher soot emissions. While the aforementioned trends are well established, there is limited literature about the high-temperature reaction zones, the liquid-phase penetration distance, and the flame tip propagation velocity of isobaric combustion. In the present study, the line-of-sight integrated imaging of Mie-scattering, combustion luminosity, and CH* chemiluminescence were conducted in an optically accessible single-cylinder heavy-duty diesel engine. The engine was equipped with a flat-bowl-shaped optical piston to allow bottom-view imaging of the combustion chamber. The experiments were conducted using n-heptane fuel for CDC and isobaric combustion modes.

Investigating combustion characteristics of oxygenated gasoline and gasoline blended ethanol is a subject of recent interest. The non-linearity in the interaction of fuel components in the oxygenated gasoline can be studied by developing chemical kinetics of relevant surrogate of fewer components. This work proposes a new reduced four-component (isooctane, heptane, toluene, and ethanol) oxygenated gasoline surrogate mechanism consisting of 67 species and 325 reactions, applicable for dynamic CFD applications in engine combustion and sprays. The model introduces the addition of eight C1-C3 species into the previous model (Li et al; 2019) followed by extensive tuning of reaction rate constants of C7 - C8 chemistry. The current mechanism delivers excellent prediction capabilities in comprehensive combustion applications with an improved performance in lean conditions.

A one-dimensional, non-equilibrium, compressible law of the wall model is proposed to increase the accuracy of heat transfer predictions from computational fluid dynamics (CFD) simulations of internal combustion engine flows on engineering grids. Our 1D model solves the transient turbulent Navier-Stokes equations for mass, momentum, energy and turbulence under the thin-layer assumption, using a finite-difference spatial scheme and a high-order implicit time integration method. A new algebraic eddy-viscosity closure, derived from the Han-Reitz equilibrium law of the wall, with enhanced Prandtl number sensitivity and compressibility effects, was developed for optimal performance. Several eddy viscosity sub-models were tested for turbulence closure, including the two-equation k-epsilon and k-omega, which gave insufficient performance.

To elucidate the complex characteristics of pre-chamber combustion engines, the interaction of the hot gas jets initiated by an active narrow throated pre-chamber with lean premixed CH4/air in a heavy-duty engine was studied computationally. A twelve-hole KAUST proprietary pre-chamber geometry was investigated using CONVERGE software. The KAUST pre-chamber has an upper conical part with the spark plug, and fuel injector, followed by a straight narrow region called the throat and nozzles connecting the chambers. The simulations were run for an entire cycle, starting at the previous cycle's exhaust valve opening (EVO). The SAGE combustion model was used with the chemistry modeled using a reduced methane oxidation mechanism based on GRI Mech 3.0, which was validated against in-house OH chemiluminescence data from the optical engine experiments.

This work explores the effectiveness of common rail fuel injectors equipped with Grouped Hole Nozzles (GHNs) in aiding the mixing process and reducing particulate matter (PM) emissions of Conventional Diesel Combustion (CDC) engines, while maintaining manageable Oxides of Nitrogen (NOx) levels. Parallel (pGHN), converging (cGHN) and diverging (dGHN) - hole GHNs were studied and the results were compared to a conventional, single hole nozzle (SHN) with the same flow area. The study was conducted on a single cylinder medium-duty engine to isolate the effects of the combustion from multi-cylinder effects and the conditions were chosen to be representative of a typical mid-load operating point for an on-road diesel engine. The effects of injection pressure and the Start of Injection (SOI) timing were explored and the tradeoffs between these boundary conditions are examined by using a response surface fitting technique, to identify an optimum operating condition.

Engine experiments were performed on a single-cylinder heavy-duty engine at relatively high loads to investigate the regions where the combustion characteristics are unchanged regardless of the fuel octane number. Primary Reference Fuels (PRFs) and three different commercial fuels with RON values ranging from 0 to 100 were tested in this study. A sweep of net indicated mean effective pressure (IMEPNet) of 5 to 20 bar, absolute intake pressure of 1.5 to 2.8 bar, exhaust gas recirculation (EGR) of 0 to 40%, and fuel injection pressure of 700 to 1400 bar were performed to investigate the combustion characteristics, ignition delay time, combustion duration, efficiency, and emissions. At the highest load point (IMEPNet = 20 bar), all the fuels burn as in conventional diesel combustion. Despite the wide range of octane numbers, all fuels had similar ignition delay time, combustion duration, indicated efficiency, and emissions at 10 to 20 bar IMEPNet.

Sector mesh modeling is the dominant computational approach for combustion system design optimization. The aim of this work is to quantify the errors descending from the sector mesh approach through three geometric modeling approaches to an optical diesel engine. A full engine geometry mesh is created, including valves and intake and exhaust ports and runners, and a full-cycle flow simulation is performed until fired TDC. Next, an axisymmetric sector cylinder mesh is initialized with homogeneous bulk in-cylinder initial conditions initialized from the full-cycle simulation. Finally, a 360-degree azimuthal mesh of the cylinder is initialized with flow and thermodynamics fields at IVC mapped from the full engine geometry using a conservative interpolation approach. A study of the in-cylinder flow features until TDC showed that the geometric features on the cylinder head (valve tilt and protrusion into the combustion chamber, valve recesses) have a large impact on flow complexity.

The long-term goal of this work is to develop a conceptual model for multiple injections of diesel jets. The current work contributes to that effort by performing a detailed modeling investigation into mechanisms that are predicted to control 1st and 2nd stage ignition in single-pulse diesel (n-dodecane) jets under different conditions. One condition produces a jet with negative ignition dwell that is dominated by mixing-controlled heat release, and the other, a jet with positive ignition dwell and dominated by premixed heat release. During 1st stage ignition, fuel is predicted to burn similarly under both conditions; far upstream, gases at the radial-edge of the jet, where gas temperatures are hotter, partially react and reactions continue as gases flow downstream. Once beyond the point of complete fuel evaporation, near-axis gases are no longer cooled by the evaporation process and 1st stage ignition transitions to 2nd stage ignition.

Engine experiments have revealed the importance of fuel condensation on the emission characteristics of low temperature combustion. However, direct in-cylinder experimental evidence has not been reported in the literature. In this paper, the in-cylinder condensation processes observed in optically accessible engine experiments are first illustrated. The observed condensation processes are then simulated using state-of-the-art multidimensional engine CFD simulations with a phase transition model that incorporates a well-validated phase equilibrium numerical solver, in which a thermodynamically consistent phase equilibrium analysis is applied to determine when mixtures become unstable and a new phase is formed. The model utilizes fundamental thermodynamics principles to judge the occurrence of phase separation or combination by minimizing the system Gibbs free energy.

Surface film formation is an important phenomenon during spray impingement in a combustion chamber. The film that forms on the chamber walls and piston bowl produces soot post-combustion. While some droplets stick to the wall surface, others splash and interact with the gas present inside the combustion chamber. Accurate prediction of both the film thickness and splashed mass is crucial for surface film model development since it leads to a precise estimation of the amount of soot and other exhaust gases formed. This information could guide future studies aimed at a comprehensive understanding of the combustion process and might enable development of engines with reduced emissions. Dynamic structure Large Eddy Simulation (LES) turbulence model implemented for in-cylinder sprays [1] has shown to predict the flow structure of a spray more accurately than the Reynolds-averaged Navier-Stokes turbulence model.

Diesel piston bowl geometry can affect turbulent mixing and therefore it impacts heat-release rates, thermal efficiency, and soot emissions. The focus of this work is on the effects of bowl geometry and injection timing on turbulent flow structure. This computational study compares engine behavior with two pistons representing competing approaches to combustion chamber design: a conventional, re-entrant piston bowl and a stepped-lip piston bowl. Three-dimensional computational fluid dynamics (CFD) simulations are performed for a part-load, conventional diesel combustion operating point with a pilot-main injection strategy under non-combusting conditions. Two injection timings are simulated based on experimental findings: an injection timing for which the stepped-lip piston enables significant efficiency and emissions benefits, and an injection timing with diminished benefits compared to the conventional, re-entrant piston.

A method for automatically generating hex-dominant meshes for Computational Fluid Dynamics (CFD) applications is presented in this article. Two important regions of the mesh for any CFD simulation are the interior mesh and the boundary layer mesh. The interior mesh needs to be fine in the critical flow regions to ensure accurate solutions. The proposed method uses Bubble Mesh algorithm which packs bubbles inside the geometry to generate the mesh nodes. Algorithm was tested for sample flow problems and improvements were made to interior and boundary layer mesh generation methods. The interior mesh is generated using directionality and sizing control functions specified on the points of a 3D grid generated over the entire geometry. This offers a flexible control over mesh sizing and local mesh refinement. Boundary layer mesh is important to accurately model the physics of boundary layer near the geometry walls.

Alcohols are potential blending agents for diesel that can be effectively used in compression ignition engines. This work investigates the use of n-butanol as a blending component for diesel fuel using experiments and simulations. Dodecane was selected as a surrogate for diesel fuel and various concentrations of n-butanol were added to study ignition characteristics. Ignition delay times for different n-butanol/dodecane blends were measured using the ignition quality tester at KAUST (KR-IQT). The experiments were conducted at pressure of 21 and 18 bar, temperature ranging from 703-843 K and global equivalence ratio of 0.85. A skeletal mechanism for n-dodecane and n-butanol blends with 203 species was developed for numerical simulations. The mechanism was developed by combining n-dodecane skeletal mechanism containing 106 species and a detailed mechanism for all the butanol isomers.

The effect of direct-injected fuel on particle size distributions (PSDs) of particulate matter emitted from dual-fuel combustion strategies was investigated. The PSD data were acquired from a light-duty single-cylinder diesel engine operated using conventional diesel combustion (CDC) and two diesel/natural gas dual-fuel combustion strategies. Three different direct-injection (DI) fuels (diesel, 2,6,10-trimethyldodecane, and a primary reference fuel blend) and two different injector nozzles were studied. The DI fuels were chosen to have similar energy and ignition characteristics (heat of combustion and cetane number) but different physical and chemical properties (volatility, aromatics %, viscosity, density). The two nozzles (with different orifice diameter and spray angle) allowed a wide range in DI fuel quantity for the dual-fuel combustion strategies.

In this paper, large eddy simulation (LES) coupled with two uncertainty quantification (UQ) methods, namely latin-hypercube sampling (LHS) and polynomial chaos expansion (PCE), have been used to quantify the effects of model parameters and spray boundary conditions on diesel and gasoline spray simulations. Evaporating, non-reacting spray data was used to compare penetration, mixture fraction and spray probability contour. Two different sets of four uncertain variables were used for diesel and gasoline sprays, respectively. UQ results showed good agreement between experiments and predictions. UQ statistics indicated that discharge coefficient has stronger impact on gasoline than diesel sprays, and spray cone angle is important for vapor penetration of both types of sprays. Additionally, examination of the gasoline spray characteristics showed that plume-to-plume interaction and nozzle dribble are important phenomena that need to be considered in high-fidelity gasoline spray simulations.

Gasoline-ethanol-methanol (GEM) blends, with constant stoichiometric air-to-fuel ratio (iso-stoichiometric blending rule) and equivalent to binary gasoline-ethanol blends (E2, E5, E10 and E15 in % vol.), were defined to investigate the effect of methanol and combined mixtures of ethanol and methanol when blended with three FACE (Fuels for Advanced Combustion Engines) Gasolines, I, J and A corresponding to RON 70.2, 73.8 and 83.9, respectively, and their corresponding Primary Reference Fuels (PRFs). A Cooperative Fuel Research (CFR) engine was used under Spark Ignition and Homogeneous Charge Compression Ignited modes. An ignition quality tester was utilized in the Compression Ignition mode. One of the promising properties of GEM blends, which are derived using the iso-stoichiometric blending rule, is that they maintain a constant octane number, which has led to the introduction of methanol as a drop-in fuel to supplement bio-derived ethanol.