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Recently, with the increasing interest on some potential alternative substitutes of petroleum fuels such as biodiesel and butanol, more and more researches are focused on the field of bio-fuels because they are renewable and friendly to the environment and can possibly reduce domestic demand on foreign petroleum. Bio-fuels are generally used in the commercial market by mixing with petroleum-based diesel or gasoline. Since the volatilities and boiling points of ethanol/butanol and diesel/biodiesel fuels are significantly different, micro-explosion can be expected in the blend mixture. In this study, a numerical model of micro-explosion including bubble generation, bubble expansion, and final breakup for multi-component bio-fuel droplets is proposed. From the simulated results of droplet characteristics at the onset of micro-explosion, it is concluded that micro-explosion is possible under engine operation condition for ethanol/butanol-diesel/biodiesel fuel blends.

Biodiesel fuels and their blends with diesel are often used to reduce emissions from diesel engines. However, biodiesel has been shown to increase the NOx emissions. Operating a compression ignition engine in low-temperature combustion mode as well as using multiple injections can reduce NOx emissions. Experimental data for biodiesel are compared to those for diesel to show the effect of the biodiesel on the peak pressure, temperature, and emissions. Accurate prediction of biodiesel properties, combined with the KIVA 3V code, is used to investigate the combustion of biodiesel. The volume fraction of the cylinder that has temperatures greater than 2200 K is shown to directly affect the production of oxides of nitrogen. Biodiesel is shown to burn faster during the combustion events, though the ignition delay is often longer for biodiesel compared to diesel.

A numerical study of micro-explosion in multi-component droplets is presented. The homogeneous nucleation theory is used in describing the bubble generation process. A modified Rayleigh equation is then used to calculate the bubble growth rate. The breakup criterion is then determined by applying a linear stability analysis on the bubble-droplet system. After the explosion/breakup, the atomization characteristics, including Sauter mean radius and averaged velocity of the secondary droplets, are calculated from conservation equations. Micro-explosion can be enhanced by introducing biodiesel into the fuel blends of ethanol and tetradecane. Micro-explosion is more likely to occur at high ambient pressure. However, increasing the ambient temperature does not have a significant effect on micro-explosion. There exists an optimal composition in the liquid mixture for micro-explosion.

The operation of a small bore high speed direct injection (HSDI) engine with a MVCO injector is simulated by the KIVA 3V code, developed by Los Alamos National Laboratory. The MVCO injector extends the range of injection timings over conventional injectors and it extra flexibility in designing injection schemes. Combustion from very early injection is observed with MVCO injections but not with conventional injection. This improves the fuel economy of the engine in terms of lower ISFC. Even better efficiency can be achieved by using biodiesel, which may be due to extra oxygen in the fuel improving the combustion process. Biodiesel sees a longer ignition delay for the initial injection. It also exhibits a faster burning rate and shorter combustion duration. Biodiesel also lowered both NOx and soot emissions. This is consistent with the general observation for soot emissions.

The KIVA-3V code, developed by Los Alamos National Laboratory, with modifications that improve its capability with biodiesel simulations was used to model the operation of an HSDI engine using blends of soybean biodiesel and diesel. Biodiesel and their blends with diesel are frequently used to reduce emissions from diesel engines, although previous studies showed that biodiesel may increase NOx emission. The paradox may be resolved by running the engine in low temperature combustion mode with biodiesel/diesel blends, as low temperature combustion simultaneously reduced NOx and soot. The modified KIVA code predicts the major combustion characteristics: peak combustion pressure, heat release rate and ignition timing accurately when compared with experimental measurements. It also correctly predicts the trend of NOx emissions. It was observed that the cylinder temperature distribution has a strong effect on emission levels.

Ternary blends of butanol-biodiesel-diesel with different blending ratios were tested inside a constant volume chamber under various ambient temperatures so as to investigate the spray and combustion characteristics of the fuels. Applying the high speed imaging, a sudden drop in spray penetration was observed at ambient temperature of 800 K and 900 K for fuels with certain blending ratio, but not at 1000 K and 1200 K. When the spray penetration of the butanol-biodiesel-diesel blends was compared to that of the biodiesel-diesel blends under non-combusting environment, a sudden drop in spray penetration length was also observed at 1100 K. The results indicated that for the non-combusting case, the tip of the spray jet erupted into a plume sometime after injection for the butanol-biodiesel-diesel blend at an ambient temperature of 1100 K. Such phenomenon was not seen with the biodiesel-diesel blend, neither with the same fuel but at a lower ambient temperature of 900 K.