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Two advanced combustion models have been validated with the KIVA-3V Release 2 code in the context of two-stage combustion in a heavy duty diesel engine. The first model uses CHEMKIN to directly integrate chemistry in each computational cell. The second model accounts for flame propagation with the G-equation, and CHEMKIN predicts autoignition and handles chemistry ahead of and behind the flame front. A Damköhler number criterion was used in flame containing cells to characterize the local mixing status and determine whether heat release and species change should be a result of flame propagation or volumetric heat release. The purpose of this criterion is to make use of physical and chemical time scales to determine the most appropriate chemistry model, depending on the mixture composition and thermodynamic properties of the gas in each computational cell.

A multi-objective genetic algorithm methodology was applied to a heavy-duty diesel engine at three different operating conditions of interest. Separate optimizations were performed over various fuel injection nozzle parameters, piston bowl geometries and swirl ratios (SR). Different beginning of injection (BOI) timings were considered in all optimizations. The objective of the optimizations was to find the best possible fuel economy, NOx, and soot emissions tradeoffs. The input parameter ranges were determined using design of experiment methodology. A non-dominated sorting genetic algorithm II (NSGA II) was used for the optimization. For the optimization of piston bowl geometry, an automated grid generator was used for efficient mesh generation with variable geometry parameters. The KIVA3V release 2 code with improved ERC sub-models was used. The characteristic time combustion (CTC) model was employed to improve computational efficiency.

A transport equation residual model incorporating refined G-equation and detailed chemical kinetics combustion models has been developed and implemented in the ERC KIVA-3V release2 code for Gasoline Direct Injection (GDI) engine simulations for better predictions of flame propagation. In the transport equation residual model a fictitious species concept is introduced to account for the residual gases in the cylinder, which have a great effect on the laminar flame speed. The residual gases include CO2, H2O and N2 remaining from the previous engine cycle or introduced using EGR. This pseudo species is described by a transport equation. The transport equation residual model differentiates between CO2 and H2O from the previous engine cycle or EGR and that which is from the combustion products of the current engine cycle.

In-cylinder flow and combustion processes simulated with the standard k-ε turbulence model and with an alternative model-employing a non-linear, quadratic equation for the turbulent stresses-are contrasted for both motored and fired engine operation at two loads. For motored operation, the differences observed in the predictions of mean flow development are small and do not emerge until expansion. Larger differences are found in the spatial distribution and magnitude of turbulent kinetic energy. The non-linear model generally predicts lower energy levels and larger turbulent time scales. With fuel injection and combustion, significant differences in flow structure and in the spatial distribution of soot are predicted by the two models. The models also predict considerably different combustion efficiencies and NOx emissions.

Low-temperature combustion (LTC) strategies for diesel engines are of increasing interest because of their potential to significantly reduce particulate matter (PM) and nitrogen oxide (NOx) emissions. LTC with late fuel injection further offers the benefit of combustion phasing control because ignition is closely coupled to the fuel injection event. But with a short ignition-delay, fuel jet mixing processes must be rapid to achieve adequate premixing before ignition. In the current study, mixing and pollutant formation of late-injection LTC are studied in a single-cylinder, direct-injection, optically accessible heavy-duty diesel engine using three laser-based imaging diagnostics. Simultaneous planar laser-induced fluorescence of the hydroxyl radical (OH) and combined formaldehyde (H2CO) and polycyclic aromatic hydrocarbons (PAH) are compared with vapor-fuel concentration measurements from a non-combusting condition.

The lift-off length plays a significant role in spray combustion as it influences the air entrainment upstream of the lift-off location and hence the soot formation. Accurate prediction of lift-off length thus becomes a prerequisite for accurate soot prediction in lifted flames. In the present study, KIVA-3v coupled with CHEMKIN, as developed at the Engine Research Center (ERC), is used as the CFD model. Experimental data from the Sandia National Labs. is used for validating the model predictions of n-heptane lift-off lengths and soot formation details in a constant volume combustion chamber. It is seen that the model predictions, in terms of lift-off length and soot mass, agree well with the experimental results for low ambient density (14.8 kg/m3) cases with different EGR rates (21% O2 - 8% O2). However, for high density cases (30 kg/m3) with different EGR rates (15% O2 - 8% O2) disagreements were found.

Homogeneous Charge Compression Ignition (HCCI) combustion is being considered as a practical solution for diesel engines due to its high efficiency and low NOx and PM emissions. However, for diesel HCCI operation, there are still several problems that need to be solved. One is the spay-wall impingement issue associated with early injection, and a further problem is the extension of HCCI operation from low load to higher engine loads. In this study, a combination of Adaptive Injection Strategies (AIS) and a Two-Stage Combustion (TSC) strategy are proposed to solve the aforementioned problems. A multi-dimensional Computational Fluid Dynamics (CFD) code with detailed chemistry, the KIVA-CHEMKIN-GA code, was employed in this study, where Genetic Algorithms (GA) were used to optimize heavy-duty diesel engine operating parameters. The TSC concept was applied to optimize the combustion process at high speed (1737 rev/min) and medium load (57% load).

A computational study was performed to evaluate the effects of bowl geometry, fuel spray targeting and swirl ratio under highly diluted, low-temperature combustion conditions in a heavy-duty diesel engine. This study is used to examine aspects of low-temperature combustion that are affected by mixing processes and offers insight into the effect these processes have on emissions formation and oxidation. The foundation for this exploratory study stems from a large data set which was generated using a genetic algorithm optimization methodology. The main results suggest that an optimal combination of spray targeting, swirl ratio and bowl geometry exist to simultaneously minimize emissions formation and improve soot and CO oxidation rates. Spray targeting was found to have a significant impact on the emissions and fuel consumption performance, and was furthermore found to be the most influential design parameter explored in this study.

Stoichiometric combustion could enable a three-way catalyst to be used for treating NOx emissions of diesel engines, which is one of the most difficult species for diesel engines to meet future emission regulations. Previous study by Lee et al. [1] showed that diesel engines can operate with stoichiometric combustion successfully with only a minor impact on fuel consumption. Low NOx emission levels were another advantage of stoichiometric operation according to that study. In this study, the characteristics of stoichiometric diesel combustion were evaluated experimentally to improve fuel economy as well as exhaust emissions The effects of fuel injection pressure, boost pressure, swirl, intake air temperature, combustion regime (injection timing), and engine load (fuel mass injected) were assessed under stoichiometric conditions.

High-speed video imaging in a swirl-supported (Rs = 1.7), direct-injection heavy-duty diesel engine operated with moderate-to-high EGR rates reveals a distinct correlation between the spatial distribution of luminous soot and mean flow vorticity in the horizontal plane. The temporal behavior of the experimental images, as well as the results of multi-dimensional numerical simulations, show that this soot-vorticity correlation is caused by the presence of a greater amount of soot on the windward side of the jet. The simulations indicate that while flow swirl can influence pre-ignition mixing processes as well as post-combustion soot oxidation processes, interactions between the swirl and the heat release can also influence mixing processes. Without swirl, combustion-generated gas flows influence mixing on both sides of the jet equally. In the presence of swirl, the heat release occurs on the leeward side of the fuel sprays.

Parametric tests using various EGR amounts, boost intake pressures, fueling rates, intake valve closings (IVC), injection pressures, and start-of-injection timings were executed to explore the limitations and potential of an intake valve actuation system on a heavy-duty diesel engine. At high-speed, intermediate load (56%) operation, constant airflow and no EGR, the use of late intake valve closing enabled a 70% NOx reduction while maintaining PM levels. Through an investigation using low load operation, late IVC, and reduced intake pressure, 2010 not-to-exceed NOx and PM emissions (0.25 g/kW-hr NOx, 0.02 g/kW-hr PM) were achieved with 40% EGR. At medium load, constant air flow, and early SOI, it was found that the NOx, HC and BSFC levels at a late IVC with 30%EGR were comparable to those with the stock camshaft IVC timing of 143°BTDC with 40%EGR. In comparison, the CO and PM levels decreased by nearly 70% with the use of late IVC timing and less EGR.

Sustainable PCI combustion was achieved in a light-duty diesel engine through the installation of a 120° spray angle nozzle and modeling-generated piston bowl geometry developed for compatibility with early start-of-injection timings. Experimental studies were conducted to determine favorable settings for boost pressure, SOI timing, and EGR rate at 2000 rev/min, 5 bar BMEP. An optimal SOI timing was discovered at 43° BTDC where soot and NOx emissions were reduced 89% and 86%, respectively. A 10% increase in fuel consumption was attributed to increased HC and CO emissions as well as non-optimal combustion phasing. Combustion noise was sufficiently attenuated through the use of high EGR rates. The maximum attainable load for PCI combustion was limited by the engine's peak cylinder pressure and cylinder pressure rise rate constraints.

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.

Optimizations were performed on a single-cylinder heavy-duty Caterpillar SCOTE 3401E engine for NOx, PM and BSFC reductions. The engine was equipped with a Caterpillar 300B HEUI fuel injection system capable of up to four injections with timings from 90 BTDC to 90 ATDC. The engine was operated at a medium load (57%), high speed (1737 rev/min) operation point. A micro-genetic algorithm was utilized to optimize a hybrid, double-injection strategy, which incorporated an early, premixed pilot injection with a late main injection. The fuel injection parameters, intake boost pressure, and EGR were considered in the optimization. The optimization produced a parameter set that met the 2007 and 2010 PM emissions mandate of 0.0134 g/kW-hr, and was within the 1.5x not to exceed NOx + HC mandate of 2.694 g/kW-hr. Following the optimization exercise, further parametric interaction studies were performed to reveal the underlying interactions and phenomena.

Numerical simulations were performed to investigate the combustion process in the Premixed Compression Ignition (PCI) regime in a light-duty diesel engine. The CHEMKIN code was implemented into an updated KIVA-3V release 2 code to simulate combustion and emission characteristics using reduced chemistry. The test engine used for validation data was a single cylinder version of a production 1.9L four-cylinder HSDI diesel engine. The engine operating condition considered was 2,000 rev/min and 5 bar BMEP load. Because high EGR levels are required for combustion retardation to make PCI combustion possible, the EGR rate was set at a relatively high level (40%) and injection timing sweeps were considered. Since injection timings were very advanced, impingement of the fuel spray on the piston bowl wall was unavoidable. To model the effects of fuel films on exhaust emissions, a drop and wall interaction model was implemented in the present code.

The heavy-duty diesel engine industry is required to meet stringent emission standards. There is also the demand for more fuel efficient engines by the customer. In a previous study on an engine with variable intake valve closure timing, the authors found that an early single injection and accompanying premixed charge compression ignition (PCCI) combustion provides advantages in emissions and fuel economy; however, unacceptably high peak pressures and rates of pressure-rise impose a severe operating constraint. The use of a Pressure Reactive Piston assembly (PRP) as a means to limit peak pressures is explored in the present work. The concept is applied to a heavy-duty diesel engine and genetic algorithms (GA) are used in conjunction with the multi-dimensional engine simulation code KIVA-3V to provide an optimized set of operating variables.

A multi-dimensional Computational Fluid Dynamics (CFD) code with detailed chemistry, the KIVA-CHEMKIN-GA code, was employed in this study, where Genetic Algorithms (GA) were used to optimize heavy-duty diesel engine operating parameters. A two-stage combustion (TSC) concept was explored to optimize the combustion process at high speed (1737 rev/min) and medium load (57% load). Two combustion modes were combined in this concept. The first stage is ideally Homogeneous Charge Compression Ignition (HCCI) combustion and the second stage is diffusion combustion under high temperature and low oxygen concentration conditions. This can be achieved for example by optimization of two-stage combustion using multiple injection or sprays from two different injectors.

Experiments were performed on a single-cylinder heavy-duty Caterpillar SCOTE 3401E engine at high speed (1737 rev/min) and loads up to 60% of full load for fully Premixed Charge Compression Ignition (PCCI) combustion. The engine was equipped with a high pressure (150 MPa) Caterpillar 300B HEUI fuel injection system. The engine was run with EGR levels up to 75% and with equivalence ratios up to 0.95. These experiments resulted in compliance of NOx and PM emissions to 2010 emissions mandates levels up to the tested load. The set of experiments also demonstrated the importance of cylinder charge preparation by way of optimized start-of-combustion timing for sufficient in-cylinder mixing. It was found that increased EGR rates, even with the correspondingly increased equivalence ratios, increase mixing time and substantially decrease PM emissions.

Although in-cylinder optical diagnostics have provided significant understanding of conventional diesel combustion, most alternative combustion strategies have not yet been explored to the same extent. In an effort to build the knowledge base for alternative low-temperature combustion strategies, this paper presents a comparison of three alternative low-temperature combustion strategies to two high-temperature conventional diesel combustion conditions. The baseline conditions, representative of conventional high-temperature diesel combustion, have either a short or a long ignition delay. The other three conditions are representative of some alternative combustion strategies, employing significant charge-gas dilution along with either early or late fuel injection, or a combination of both (double-injection).

Low-temperature combustion concepts that utilize cooled EGR, early/retarded injection, high swirl ratios, and modest compression ratios have recently received considerable attention. To understand the combustion and, in particular, the soot formation process under these operating conditions, a modeling study was carried out using the KIVA-3V code with an improved phenomenological soot model. This multi-step soot model includes particle inception, surface growth, surface oxidation, and particle coagulation. Additional models include a piston-ring crevice model, the KH/RT spray breakup model, a droplet wall impingement model, a wall heat transfer model, and the RNG k-ε turbulence model. The Shell model was used to simulate the ignition process, and a laminar-and-turbulent characteristic time combustion model was used for the post-ignition combustion process.