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This research investigates how the handling of mixing and heat transfer in a multi-zone kinetic solver affects the prediction of carbon monoxide and hydrocarbon emissions for simulations of HCCI engine combustion. A detailed kinetics multi-zone model is now more closely coordinated with the KIVA3V computational fluid dynamics code for simulation of the compression and expansion processes. The fluid mechanics is solved with high spatial and temporal resolution (40,000 cells). The chemistry is simulated with high temporal resolution, but low spatial resolution (20 computational zones). This paper presents comparison of simulation results using this enhanced multi-zone model to experimental data from an isooctane HCCI engine.

The dynamic stage of combustion - the intrinsic process for pushing the compression polytrope away from the expansion polytrope to generate the indicator work output of a piston engine - was studied to reveal the influence of the air/fuel ratio on the effectiveness with which the fuel was utilized. The results of tests carried out for this purpose, using a 12 liter diesel engine, were reported last year [SAE 1999-01-0517]. Presented here is an analytic interpretation of the data obtained for part-load operation at 1200 and 1800 rpm. A solution is thus provided for an inverse problem: deduction of information on the dynamic features of the exothermic process of combustion from measured pressure record. Provided thereby, in particular, is information on the effectiveness with which fuel was utilized in the course of this process - a parameter reflecting the effect of energy lost by heat transfer to the walls.

The refinement of heat release analysis stems from the recognition that a combustion system is intrinsically non-linear. Thus, as appropriate for such an entity, its properties are expressed in terms of a thermochemical phase (or state) space, of which the thermodynamic aspects are exposed on a so-called Le Chatelier diagram, providing the fundamental background for the development of micro-electronic control to attain the most effective utilization of fuel. Implementation of this method of approach is illustrated by the analysis of the exothermic process taking place in two typical internal combustion engines, spark-ignition and diesel.

This is a continuation of the presentation of thermodynamic properties of selected fuel-air mixtures in chart form, suitable for utilization in engine performance calculations. Methane and propane, representative of natural gas and LPG are the two fuels considered. Using these charts, comparisons are made between the performance to be expected with these gaseous fuels compared to octane, as representative of gasoline. Reduced engine power is predicted and this is confirmed by experience of other investigators.

A digital computer and special program were used, along with new thermodynamic data, to recalculate and extend the scope and range of the classic combustion gas charts of Hottel and co-workers. A series of hydrocarbon and nonhydrocarbon fuels was treated over a range of fuel-air ratios, with temperatures extended up to 7200 R and pressures up to 15,000 psia. This, the first paper of a series, incorporates the resulting charts for isooctane at four mixture ratios ranging from 20% lean to 40% rich. Auxiliary charts for inducted mixture properties determination and a set of sample calculations are also included.