Large eddy simulation of spray and combustion characteristics of biodiesel and biodiesel/butanol blend fuels in internal combustion engines

Biofuel is a crucial renewable and environmentally friendly energy source for addressing greenhouse gas emissions and other energy-related issues. Biodiesel and butanol, among alternative biofuels, possess com-plementary physical and chemical properties, offering multiple possibilities for their use in existing internal combustion engines. However, biodiesel's distinctly different physical and combustion properties from conven-tional diesel fuels make its combustion process substantially different. The complex composition of biodiesel presents significant challenges in accurately simulating its spray combustion characteristics. This paper presents a systematic evaluation of six single-component surrogate fuel models and a five-component model for the prediction of biodiesel spray characteristics under various conditions using large-eddy simulation (LES). The results show that single-component surrogate fuel models can only predict the gaseous penetration of biodiesel but not the liquid-phase penetration. A five-component fatty acid methyl ester surrogate fuel model is proposed, demonstrating an accurate simulation of biodiesel spray evaporation characteristics under different conditions. Based on the five-component evaporation model, LES is utilized to examine three strategies of biodiesel/butanol-fueled internal combustion engines: direct injection of pure biodiesel in conventional diffusion-controlled combustion (CDC) engines, direct injection of biodiesel-butanol blend in CDC engines, and biodiesel/butanol reactivity-controlled compression ignition (RCCI) engines. The simulation results are validated against engine experiment results, showing that the five-component model can successfully predict spray and combustion characteristics in internal combustion engines. The RCCI concept can significantly reduce NOx emissions; however, CO and UHC emissions are higher than in the CDC engines due to incomplete combustion in the fuel-lean butanol/air mixture.