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This paper shows how a computer can systematically remove non-essential chemical reactions from a large chemical kinetic mechanism. The computer removes the reactions based upon a single solution using a detailed mechanism. The resulting reduced chemical mechanism produces similar numerical predictions significantly faster than predictions that use the detailed mechanism. Specifically, a reduced chemical kinetics mechanism for iso-octane has been derived from a detailed mechanism by eliminating unimportant reaction steps and species. The reduced mechanism has been developed for the specific purpose of fast and accurate prediction of ignition timing in an HCCI engine. The reduced mechanism contains 199 species and 383 reactions, while the detailed mechanism contains 859 species and 3606 reactions. Both mechanisms have been used in numerical simulation of HCCI combustion.

We have developed a methodology for predicting combustion and emissions in a Homogeneous Charge Compression Ignition (HCCI) Engine. The methodology judiciously uses a fluid mechanics code followed by a chemical kinetics code to achieve great reduction in the computational requirements; to a level that can be handled with current computers. In previous papers, our sequential, multi-zone methodology has been applied to HCCI combustion of short-chain hydrocarbons (natural gas and propane). Applying the same procedure to long-chain hydrocarbons (iso-octane) results in unacceptably long computational time. In this paper, we show how the computational time can be made acceptable by developing a segregated solver. This reduces the run time of a ten-zone problem by an order of magnitude and thus makes it much more practical to make combustion studies of long-chain hydrocarbons.

This paper describes a hybrid vehicle simulation model which can be applied to many of the vehicles currently being considered for low emissions and high fuel economy. The code operates in batch mode with all the vehicle information stored in data files. The code calculates power train dimensions, fuel economy for three driving schedules, time for 0 - 96 km/h at maximum acceleration, hill climbing performance, and emissions. This paper also documents the application of the code to a hybrid vehicle that utilizes a hydrogen internal combustion engine. The simulation model is used for parametric studies of the vehicle. The results show the fuel economy of the vehicle as a function of vehicle mass, aerodynamic drag, engine efficiency, accessory load, and flywheel efficiency. The code also calculates the minimum flywheel energy and power to obtain a desired performance.

Homogeneous Charge Compression Ignition (HCCI) combustion is a process dominated by chemical kinetics of the fuel-air mixture. The hottest part of the mixture ignites first, and compresses the rest of the charge, which then ignites after a short time lag. Crevices and boundary layers generally remain too cold to react, and result in substantial hydrocarbon and carbon monoxide emissions. Turbulence has little effect on HCCI combustion, and may be most important as a factor in determining temperature gradients and boundary layer thickness inside the cylinder. The importance of thermal gradients inside the cylinder makes it necessary to use an integrated fluid mechanics-chemical kinetics code for accurate predictions of HCCI combustion. However, the use of a fluid mechanics code with detailed chemical kinetics is too computationally intensive for today's computers.

We have developed a methodology for predicting combustion and emissions in a Homogeneous Charge Compression Ignition (HCCI) Engine. This methodology combines a detailed fluid mechanics code with a detailed chemical kinetics code. Instead of directly linking the two codes, which would require an extremely long computational time, the methodology consists of first running the fluid mechanics code to obtain temperature profiles as a function of time. These temperature profiles are then used as input to a multi-zone chemical kinetics code. The advantage of this procedure is that a small number of zones (10) is enough to obtain accurate results. This procedure achieves the benefits of linking the fluid mechanics and the chemical kinetics codes with a great reduction in the computational effort, to a level that can be handled with current computers.

An experimental study of the Homogeneous Charge Compression Ignition (HCCI) combustion process has been conducted by using chemiluminescence imaging. The major intent was to characterize the flame structure and its transient behavior. To achieve this, time resolved images of the naturally emitted light were taken. Emitted light was studied by recording its spectral content and applying different filters to isolate species like OH and CH. Imaging was enabled by a truck-sized engine modified for optical access. An intensified digital camera was used for the imaging. Some imaging was done using a streak-camera, capable of taking eight arbitrarily spaced pictures during a single cycle, thus visualizing the progress of the combustion process. All imaging was done with similar operating conditions and a mixture of n-heptane and iso-octane was used as fuel. Some 20 crank angles before Top Dead Center (TDC), cool flames were found to exist.

Mixing in wall-jets was investigated in an optical heavy-duty diesel engine with several injector configurations and injection pressures. Laser-induced fluorescence (LIF) was employed in non-reacting conditions in order to quantitatively measure local equivalence ratios in colliding wall-jets. A novel laser diagnostic technique, Structured Laser Illumination Planar Imaging (SLIPI), was successfully implemented in an optical engine and permits to differentiate LIF signal from multiply scattered light. It was used to quantitatively measure local equivalence ratio in colliding wall-jets under non-reacting conditions. Mixing phenomena in wall-jets were analyzed by comparing the equivalence ratio in the free part of the jet with that in the recirculation zone where two wall-jets collide. These results were then compared to φ predictions for free-jets. It was found that under the conditions tested, increased injection pressure did not increase mixing in the wall-jets.

The novel wave-shaped bowl piston geometry design with protrusions has been proved in previous studies to enhance late-cycle mixing and therefore significantly reduce soot emissions and increase engine thermodynamic efficiency. The wave-shaped piston is characterized by the introduction of evenly spaced protrusions around the inner wall of the bowl, with a matching number with the number of injection holes, i.e., flames. The interactions between adjacent flames strongly affect the in-cylinder flow and the wave shape is designed to guide the near-wall flow. The flow re-circulation produces a radial mixing zone (RMZ) that extends towards the center of the piston bowl, where unused air is available for oxidation promotion. The waves enhance the flow re-circulation and thus increase the mixing intensity of the RMZ.

The soot distribution as function of ambient O₂ mole fraction in a heavy-duty diesel engine was investigated at low load (6 bar IMEP) with laser-induced incandescence (LII) and natural luminosity. A Multi-YAG laser system was utilized to create time-resolved LII using 8 laser pulses with a spacing of one CAD with detection on an 8-chip framing camera. It is well known that the engine-out smoke level increases with decreasing oxygen fraction up to a certain level where it starts to decrease again. For the studied case the peak occurred at an O₂ fraction of 11.4%. When the oxygen fraction was decreased successively from 21% to 9%, the initial soot formation moved downstream in the jet. At the lower oxygen fractions, below 12%, no soot was formed until after the wall interaction. At oxygen fractions below 11% the first evidence of soot is in the recirculation zone between two adjacent jets.

A heavy duty diesel engine operating case producing no engine-out smoke was studied using combined simultaneous optical diagnostics. The case was close to a typical low load modern diesel operating point without EGR. Parallels were drawn to the conceptual model by Dec and results from high-pressure combustion vessels. Optical results revealed that no soot was present in the upstream part of the jet cross-section. Soot was only observed in the recirculation zones close to the bowl perimeter. This indicated very slow soot formation and was explained by a significantly higher air entrainment rate than in Dec's study. The local fuel-air equivalence ratio, Φ, at the lift-off length was estimated to be 40% of the value in Dec's study. The lower Φ in the jet produced a different Φ -T-history, explaining the soot results. The increased air entrainment rate was mainly due to smaller nozzle holes and increased TDC density.

The local equivalence ratio, Φ, was measured in fuel jets using laser-induced spontaneous Raman scattering in an optical heavy duty diesel engine. The measurements were performed at 1200 rpm and quarter load (6 bar IMEP). The objective was to study factors influencing soot formation, such as gas entrainment and lift-off position, and to find correlations with engine-out particulate matter (PM) levels. The effects of nozzle hole size, injection pressure, inlet oxygen concentration, and ambient density at TDC were studied. The position of the lift–off region was determined from OH chemiluminescence images of the flame. The liquid penetration length was measured with Mie scattering to ensure that the Raman measurement was performed in the gaseous part of the spray. The local Φ value was successfully measured inside a fuel jet. A surprisingly low correlation coefficient between engine-out PM and the local Φ in the reaction zone were observed.

This paper illustrates the applicability of a sequential fluid mechanics, multi-zone chemical kinetics model to analyze HCCI experimental data for two combustion chamber geometries with different levels of turbulence: a low turbulence disc geometry (flat top piston), and a high turbulence square geometry (piston with a square bowl). The model uses a fluid mechanics code to determine temperature histories in the engine as a function of crank angle. These temperature histories are then fed into a chemical kinetic solver, which determines combustion characteristics for a relatively small number of zones (40). The model makes the assumption that there is no direct linking between turbulence and combustion. The multi-zone model yields good results for both the disc and the square geometries. The model makes good predictions of pressure traces and heat release rates.

Laser-Induced Incandescence (LII) has traditionally been considered a straightforward and reliable optical diagnostic technique for in-cylinder soot measurements. As a result, it is nowadays even possible to buy turn-key LII measurement systems. During recent years, however, attention has been drawn to a number of unresolved challenges with LII. Many of these are relevant mostly for particle sizing using time-resolved LII, but also two-dimensional soot volume fraction measurements are affected, especially in regions with high soot concentrations typically found in combustion engines. In this work the focus is on the specific challenges involved in performing high-repetition rate measurements with LII in diesel engines. All the mentioned issues might not be possible to overcome but they should nevertheless be known and their potential impact should be considered.

Soot emissions from diesel internal combustion engines are strictly regulated nowadays. Laser extinction measurement (LEM) and natural luminosity (NL) of sooty flames are commonly applied to study soot. LEM measures soot along the laser beam path and it can probe soot regardless of temperature. NL integrates the whole field of view and relies on soot temperature. In this work, a comparison of simultaneously recorded LEM and NL data has been performed in a heavy-duty optical engine. A 685 nm laser beam is used for LEM. The laser was modulated at 63 kHz, which facilitated subtraction of the background NL signal from the raw LEM data. By Beer-Lambert’s law, KL factor can be calculated and used as a metric to describe soot measurements. A compensation of transmitted laser intensity fluctuation and soot deposits on optical windows has been performed in this work.

In-cylinder heat losses in diesel engines reduce engine efficiency significantly and account for a considerable amount of injected fuel energy. A great part of the heat losses during diesel combustion presumably arises from the impingement of the flame. The present study compares the heat losses at the point where the flame impinges onto the piston bowl wall and the heat losses between two impingement points. Measurements were performed in a full metal heavy-duty diesel engine with a small optical access through a removed exhaust valve. The surface temperature at the impingement point of the combusting diesel spray and at a point in between two impingement points was determined using phosphor thermometry. The dynamic heat fluxes and the heat transfer coefficients which result from the surface temperature measurements are estimated. Simultaneous cylinder pressure measurements and high-speed videos are associated to individual surface temperature measurements.

The presence of OH radicals as a marker of the high temperature reaction region usually has been used to determine the lift-off length (LOL) in diesel engines. Both OH Laser Induced Fluorescence (LIF) and OH* chemiluminescence diagnostics have been widely used in optical engines for measuring the LOL. OH* chemiluminescence is radiation from OH being formed in the exited states (OH*). As a consequence OH* chemiluminescence imaging provides line-of-sight information across the imaged volume. In contrast, OH-LIF provides information on the distribution of radicals present in the energy ground state. The OH-LIF images only show OH distribution in the thin cross-section illuminated by the laser. When both these techniques have been applied in earlier work, it has often been reported that the chemiluminescence measurements result in shorter lift-off lengths than the LIF approach.

This paper describes the Homogeneous charge compression ignition (HCCI) research activities being currently pursued at Lawrence Livermore National Laboratory and at the University of California Berkeley. Current activities include analysis as well as experimental work. HCCI is an old combustion technology that may now be developed with expectations of high efficiency, low NOx, and low particulate matter emissions; in short, an alternative to diesel engines. On analysis, we have developed two powerful tools: a single zone model and a multi-zone model. The single zone model has proven very successful in predicting start of combustion and providing reasonable estimates for peak cylinder pressure, indicated efficiency and NOX emissions. This model is being applied to develop detailed engine performance maps and control strategies, and to analyze the problem of engine startability.

Cycle resolved wall temperature measurements have been performed in a one cylinder port injected optical Scania D12 truck engine run in HCCI mode. Point measurements at various locations were made using Laser-Induced Phosphorescence (LIP). Single point measurements with thermographic phosphors utilize the temperature dependancy of the phosphorescence decay time. The phosphorescence peak at 538 nm from the thermographic phosphor La2O2S:Eu was used to determine temperature. A frequency tripled 10 Hz pulsed Nd:YAG laser delivering ultra violet (UV) radiation at 355 nm was used for excitation of the phosphor. Detection in the spectral region 535 - 545 nm was performed every cycle with a photo multiplier tube connected to a 3 GHz oscilloscope. Measurements were made at four points on the cylinder head surface and two points on the outlet and inlet valves respectively. For each location measurements were made at different loads and at different crank angle degrees (CAD).

The potential of a Homogeneous Charge Compression Ignition (HCCI) engine with variable compression ratio has been experimentally investigated. The experiments were carried out in a single cylinder engine, equipped with a modified cylinder head. Altering the position of a secondary piston in the cylinder head enabled a change of the compression ratio. The secondary piston was controlled by a hydraulic system, which was operated from the control room. Dual port injection systems were used, which made it possible to change the ratio of two different fuels with the engine running. By mixing iso-octane with octane number 100 and normal heptane with octane number 0, it was possible to obtain any octane rating between 0 and 100. By using an electrical heater for the inlet air, it was possible to adjust the inlet air temperature to a selected value.

This work aims to study the effect of fuel inhomogeneity on the ignition process and subsequent combustion in a compression ignition Partially Premixed Combustion (PPC) engine using a primary reference fuel (PRF) in low load conditions. Five cases with injection timings ranging from the start of injection (SOI) at -70 crank angle degrees (CAD) to -17 CAD have been studied numerically and experimentally in a heavy duty (HD) piston bowl geometry. Intake temperature is adjusted to keep the combustion phasing constant. Three dimensional numerical simulations are performed in a closed cycle sector domain using the Reynolds Averaged Navier-Stokes (RANS) formulation with k-ϵ turbulence closure and direct coupling of finite rate chemistry. The results are compared with engine experiments. The predicted trends in required intake temperature and auto-ignition location for a constant combustion phasing are consistent with experiments.