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The paper presents the development of a novel approach to the solution of detailed chemistry in internal combustion engine simulations, which relies on the analytical computation of the ordinary differential equations (ODE) system Jacobian matrix in sparse form. Arbitrary reaction behaviors in either Arrhenius, third-body or fall-off formulations can be considered, and thermodynamic gas-phase mixture properties are evaluated according to the well-established 7-coefficient JANAF polynomial form. The current work presents a full validation of the new chemistry solver when coupled to the KIVA-4 code, through modeling of a single cylinder Caterpillar 3401 heavy-duty engine, running in two-stage combustion mode.

The low temperature combustion concept is very attractive for reducing NOx and soot emissions in diesel engines. However, it has potential limitations due to higher combustion noise, CO and HC emissions. A multiple injection strategy is an effective way to reduce unburned emissions and noise in LTC. In this paper, the effect of multiple injection strategies was investigated to reduce combustion noise and unburned emissions in LTC conditions. A hybrid surrogate fuel model was developed and validated, and was used to improve LTC predictions. Triple injection strategies were considered to find the role of each pulse and then optimized. The split ratio of the 1st and 2nd pulses fuel was found to determine the ignition delay. Increasing mass of the 1st pulse reduced unburned emissions and an increase of the 3rd pulse fuel amount reduced noise. It is concluded that the pulse distribution can be used as a control factor for emissions and noise.

Reactivity-controlled compression ignition (RCCI) has been shown to be capable of providing improved engine efficiencies coupled with the benefit of low emissions via in-cylinder fuel blending. Much of the previous body of work has studied the benefits of RCCI operation using high injection pressures (e.g., 500 bar or greater) with common rail injection (CRI) hardware. However, low-pressure fueling technology is capable of providing significant cost savings. Due to the broad market adoption of gasoline direct injection (GDI) fueling systems, a market-type prototype GDI injector was selected for this study. Single-cylinder light-duty engine experiments were undertaken to examine the performance and emissions characteristics of the RCCI combustion strategy with low-pressure GDI technology and compared against high injection pressure RCCI operation. Gasoline and diesel were used as the low-reactivity and high-reactivity fuels, respectively.

Two-Color imaging optics were developed and used to observe soot emission processes in a modern heavy-duty diesel engine. The engine was equipped with a common rail, electronically-controlled, high-pressure fuel injection system that is capable of up to four injection pulses per engine cycle. The engine was instrumented with an endoscope system for optical access for the combustion visualization. Multidimensional combustion and soot modeling results were used for comparisons to enhance the understanding and interpretation of the experimental data. Good agreement between computed and measured cylinder pressures, heat release and soot and NOx emissions was achieved. In addition, good qualitative agreement was found between in-cylinder soot concentration (KL) and temperature fields obtained from the endoscope images and those obtained from the multidimensional modeling.

An experimental study of luminous combustion in a modern diesel engine was performed to investigate the effect of injection parameters on NOX and soot formation via flame temperature and soot KL factor measurements. The two-color technique was applied to 2-D soot luminosity images and area-averaged soot radiation signals to obtain spatially and temporally resolved flame temperature and soot KL factor. The imaging system used for this study was based on a wide-angle endoscope that was mounted in the cylinder head and allowed different views of the combustion chamber. The experiments were carried out on a single-cylinder 2.4 liter D.I. diesel engine equipped with an electronically controlled common-rail injection system. Operating conditions were 1600 rpm and 75% load. The two-color results confirm that retarding the injection timing causes lower flame temperatures and NOX emissions but increased soot formation, independent of injection strategy.

The development of analytic models of diesel engine flow, combustion and subprocesses is described. The models are intended for use as design tools by industry for the prediction of engine performance and emissions to help reduce engine development time and costs. Part of the research program includes performing engine experiments to provide validation data for the models. The experiments are performed on a single-cylinder version of the Caterpillar 3406 engine that is equipped with state-of-the-art high pressure electronic fuel injection and emissions instrumentation. In-cylinder gas velocity and gas temperature measurements have also been made to characterize the flows in the engine.

Time-resolved measurements were made of the gas composition at the exhaust port of a direct-injection two-stroke engine operating at 2000 rpm and an air-fuel ratio of 30:1. A high-speed sampling valve capable of 1.0 ms (12 CAD) time resolution was used to collect samples 1 cm downstream of the exhaust port of the engine. The time-resolved NOx, CO2 and CO concentrations decreased continuously during the scavenging process due to the dilution by short-circuited air. The hydrocarbon emissions, however, behaved significantly differently from the other species. At the time of exhaust port opening the concentration was low, it reached a maximum value by BDC, then decreased slightly in the latter part of the scavenging event. The dilution rates calculated for the hydrocarbon data gave negative values, indicating that there was a significant production of hydrocarbons during the gas exchange period.

Experimental studies have been undertaken on a single-cylinder HPCR diesel engine with a compression ratio of 15.5:1 to explore the effect of fuel injection strategy on cycle by cycle stability. The influence of the number, separation and quantity of pilot injections on the coefficient of variation of IMEP has been investigated at -20°C, 1000 rev/min, post-start idling conditions. Injection strategy and glow plug temperature trade-off has also been investigated at a range of soak temperatures. Up to four pilot injections have been used. For timing of the main injection near to the optimum, CoVIMEP values of 10% or better can be achieved. Closer spacing of injections improved stability and extended the range of timings to meet target stability. The best combinations of pilot number and pilot quantity varied with total fuel delivered.

The effect of compression ratio on sensitivity to changes in start of injection and air-fuel ratio has been investigated on a single-cylinder DI diesel engine at fixed low and medium speeds and loads. Compression ratio was set to 17.9:1 or 13.7:1 by using pistons with different bowl sizes. Injection timing and air-to-fuel ratio were swept around a nominal map point at which gross IMEP and NOx values were matched for the two compression ratios. It was found that CO, HC and ISFC were higher at low compression ratio, but the soot/NOx trade-off improved and this could be exploited to reduce the fuel economy penalty. Sensitivity to inputs is generally similar, but high compression ratio tended to have steeper response gradients. Reducing compression ratio to 13.7 gave rise to a marked degradation of performance at light load, producing high CO emissions and a fall in combustion efficiency. This could be eased by reducing rail pressure, but the advantage in smoke emission was lost.

An electronically controlled Caterpillar single-cylinder oil test engine (SCOTE) was used to study diesel combustion. The SCOTE retains the port, combustion chamber, and injection geometry of the production six cylinder, 373 kW (500 hp) 3406E heavy-duty truck engine. The engine was equipped with an electronic unit injector and an electronically controlled common rail injector that is capable of multiple injections. An emissions investigation was carried out using a six-mode cycle simulation of the EPA Federal Transient Test Procedure. The results show that the SCOTE meets current EPA mandated emissions levels, despite the higher internal friction imposed by the single-cylinder configuration. NOx versus particulate trade-off curves were generated over a range of injection timings for each mode and results of heat release calculations were examined, giving insight into combustion phenomena in current “state of the art” heavy-duty diesel engines.

An operational scheme with fuel-lean and exhaust gas dilution in spark-ignited engines increases thermal efficiency and decreases NOx emission, while these operations inherently induce combustion instability and thus large cycle-to-cycle variation in engine. In order to stabilize combustion variations, the development of an advanced ignition system is becoming critical. To quantify the impact of spark-ignition discharge, ignitability tests were conducted in an optically accessible combustion vessel to characterize the flame kernel development of lean methane-air mixture with CO₂ simulating exhaust diluent. A shrouded fan was used to generate turbulence in the vicinity of J-gap spark plug and a Variable Output Ignition System (VOIS) capable of producing a varied set of spark discharge patterns was developed and used as an ignition source. The main feature of the VOIS is to vary the secondary current during glow discharge including naturally decaying and truncated with multiple strikes.

To overcome the trade-off between NOx and particulate emissions for future diesel vehicles and engines it is necessary to seek methods to lower pollutant emissions. The desired simultaneous improvement in fuel efficiency for future DI (Direct Injection) diesels is also a difficult challenge due to the combustion modifications that will be required to meet the exhaust emission mandates. This study demonstrates the emission reduction capability of split injections, EGR (Exhaust Gas Recirculation), and other parameters on a High Speed Direct Injection (HSDI) diesel engine equipped with a common rail injection system using an RSM (Response Surface Method) optimization method. The optimizations were conducted at 1757 rev/min, 45% load. Six factors were considered for the optimization, namely the EGR rate, SOI (Start of Injection), intake boost pressure, and injection pressure, the percentage of fuel in the first injection, and the dwell between injections.

A study was performed in which the effects on the regulated emissions from a commercial small DI diesel engine were measured for different refinery-derived fuel blends. Seven different fuel blends were tested, of which two were deemed to merit more detailed evaluation. To investigate the effects of fuel properties on the combustion processes with these fuel blends, two-color pyrometry was used via optically accessible cylinderheads. Additional data were obtained with one of the fuel blends with a heavy-duty DI diesel engine. California diesel fuel was used as a baseline. The fuel blends were made by mixing the components typically found in gasoline, such as methyl tertiary-butyl ether (MTBE) and whole fluid catalytic cracking gasoline (WH-FCC). The mixing was performed on a volume basis. Cetane improver (CI) was added to maintain the same cetane number (CN) of the fuel blends as that of the baseline fuel.

The role of mixture stratification on combustion rate has been investigated in a constant volume combustion vessel in which mixtures of different equivalence ratios can be added in a spatially and temporally controlled fashion. The experiments were performed in a regime of low fluid motion to avoid the complicating effects of turbulence generated by the injection of different masses of fluid. Different mixture combinations were investigated while maintaining a constant overall equivalence ratio and initial pressure. The results indicate that the highest combustion rate for an overall lean mixture is obtained when all of the fuel is contained in a stoichiometric mixture in the vicinity of the ignition source. This is the result of the high burning velocity of these mixtures, and the complete oxidation which releases the full chemical energy.

Engine-out CO emission and fuel conversion efficiency were measured in a highly-dilute, low-temperature diesel combustion regime over a swirl ratio range of 1.44-7.12 and a wide range of injection timing. At fixed injection timing, an optimal swirl ratio for minimum CO emission and fuel consumption was found. At fixed swirl ratio, CO emission and fuel consumption generally decreased as injection timing was advanced. Moreover, a sudden decrease in CO emission was observed at early injection timings. Multi-dimensional numerical simulations, pressure-based measurements of ignition delay and apparent heat release, estimates of peak flame temperature, imaging of natural combustion luminosity and spray/wall interactions, and Laser Doppler Velocimeter (LDV) measurements of in-cylinder turbulence levels are employed to clarify the sources of the observed behavior.

This research focused on the effects of split injection on combustion in a diesel environment. It was done in a specially designed engine-fed combustion chamber (swirl ratio of 5) with full field optical access through a quartz window. The simulated engine combustion chamber used a special backwards spraying injector (105°). The electronically controlled injector could control the size and position of it's, two injections. Both injections were through the same nozzle and it produced very rapid injections (1.5 ms) with a maximum injection pressure of 130 MPa. Experimental data included: rate of injection, injector pressure, combustion chamber dumping (NO & NOx concentrations), flame temperature, KL factor (soot concentration) combustion pressure, and rate of pressure rise. Injection rates indicate that the UCORS injection system creates very rapid injections with the ability to produce controllable split injections.

This research focused on the effects of split injection on fuel spray behavior in a diesel environment. It was done in a special designed engine-fed combustion chamber (swirl ratio of 5) with full field optical access through a quartz window. The simulated engine combustion chamber used a special backwards spraying injector (105°). The electronically controlled injector could control the size and position of it's two injections. Both injections were through the same nozzle and it produced very rapid injections (1.5 ms) with a maximum injection pressure of 130 MPa. Experimental data included: rate of injection, injector pressure, spray plume images, tip penetration, liquid and vapor fuel distributions, combustion pressure, and rate of pressure rise. From 105° forward scatter images, tip penetration was observed to be very rapid and reached a plateau at 25 mm.

An integrated numerical model has been developed for diesel engine computations based on the KIVA-II code. The model incorporates a modified RNG k-ε, turbulence model, a ‘wave’ breakup spray model, the Shell ignition model, the laminar-and-turbulent characteristic-time combustion model, a crevice flow model, a spray/wall impingement model that includes rebounding and breaking-up drops, and other improved submodels in the KIVA code. The model was validated and applied to model successfully different types of diesel engines under various operating conditions. These engines include a Caterpillar engine with different injection pressures at different injection timings, a small Tacom engine at different loads, and a Cummins engine modified by Sandia for optical experiments. Good levels of agreement in cylinder pressures and heat release rate data were obtained using the same computer model for all engine cases.

Diesel fuels are complex mixtures of thousands of hydrocarbons. Since modeling their combustion characteristics with the inclusion of all hydrocarbon species is not feasible, a hybrid surrogate model approach is used in the present work to represent the physical and chemical properties of three different diesel fuels by using up to 13 and 4 separate hydrocarbon species, respectively. The surrogates are arrived at by matching their distillation profiles and important properties with the real fuel, while the chemistry surrogates are arrived at by using a Group Chemistry Representation (GCR) method wherein the hydrocarbon species in the physical property surrogates are grouped based on their chemical classes, and the chemistry of each class is represented by using up to two hydrocarbon species.

A study was performed that takes into account both turbulence and chemical kinetic effects in the numerical simulation of diesel engine combustion in order to better understand the importance of their respective roles at changing operating conditions. An approach was developed which combines the simplicity and low computational and storage requests of the laminar-and-turbulent characteristic-time model with a detailed combustion chemistry model based on well-known simplified mechanisms. Assuming appropriate simplifications such as steady state or equilibrium for most of the radicals and intermediate species, the kinetics of hydrocarbons can be described by means of three overall steps. This approach was integrated in the KIVA-II code. The concept was validated and applied to a single-cylinder, heavy-duty engine. The simulation covers a wide range of operating conditions.