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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.

Engine experiments have shown that with high-pressure multiple injections (two or more injection pulses per power cycle), the soot-NOx trade-off curves of a diesel engine can be shifted closer to the origin than those with the conventional single-pulse injections, reducing both soot and NOx emissions significantly. In order to understand the mechanism of emissions reduction, multidimensional computations were carried out for a heavy-duty diesel engine with multiple injections. Different injection schemes were considered, and the predicted cylinder pressure, heat release rate and soot and NOx emissions were compared with measured data. Excellent agreements between predictions and measurements were achieved after improvements in the models were made. The improvements include using a RNG k-ε turbulence model, adopting a new wall heat transfer model and introducing the nozzle discharge coefficient to account for the contraction of fuel jet at the nozzle exit.

In previous work the KIVA-II code has been modified to model modem DI diesel engines and their emissions of particulate soot and oxides of nitrogen (NOx). This work presents results from a program to further validate the NOx emissions models against engine experiments with a well characterized modern engine. To facilitate a simplified comparison with experiments, a single cylinder research version of the Caterpillar 3406 heavy duty DI diesel engine was retrofitted to run as a naturally-aspirated, propane-fueled, spark-ignited engine. The retrofit includes installing a low compression ratio piston with bowl, adding a gas mixer, replacing the fuel injector assembly with a spark plug assembly and adding spark and fuel stoichiometry control hardware. Cylinder pressure and engine-out NOx emissions were measured for a range of speeds, exhaust gas residual (EGR) fractions, and spark timing settings.