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Combustion simulation is an effective tool in overcoming the issues associated with gasoline HCCI engines, controlling ignition timing and extending the operating range. The research discussed in this paper commenced by optimizing the reaction mechanism from the perspective of ignition delay using the genetic algorithm (GA) method. Simulations employing the optimized reaction mechanism were then able to more accurately reproduce the ignition timing of iso-octane and primary reference fuels (PRF). Ignition times obtained from simulations showed excellent correlation with ignition times measured using these fuels in shock tube experiments, and in engines with both homogeneous and non-homogeneous fuel distributions. The use of the PRF mechanism for gasoline with an equivalent octane number enables excellent reproduction of ignition timing even when EGR is employed.

Vaporization models for continuous multi-component liquid sprays and liquid wall films are presented using a continuous thermodynamics formulation. The models were implemented in the KIVA3V-Release 2.0 code. The models are first applied to clarify the characteristics of vaporizing continuous multi-component liquid wall films and liquid drops, and then applied to numerically analyze a practical continuous multi-component fuel - gasoline behavior in a 4-valve port fuel injection (PFI) gasoline engine under warm conditions. Corresponding computations with single-component fuels are also performed and presented for comparison purposes. As compared to the results of its single-component counterpart, the vaporizing continuous multi-component fuel drop displays a larger vaporization rate initially and a smaller vaporization rate as it becomes more and more dominated by heavy species.