Combustion in direct-injection diesel engines occurs in a lifted, turbulent diffusion flame mode. Numerous studies indicate that the combustion and emissions in such engines are strongly influenced by the iifted flame characteristics, which are in turn determined by fuel and air mixing in the upstream region of the lifted flame, and consequently by the liquid breakup and spray deveiopment processes. From a numerical standpoint, these spray combustion processes depend heavily on the choice of underlying spray, combustion, and turbulence models. The present numerical study investigates the influence of different chemical kinetic mechanisms for diesei and biodiesel fuels, as well as Reynoldsaveraged Navier-Stokes (RANS)
and large eddy simulation (LES) turbulence models on predicting flame iift-off lengths (LOLs) and ignition delays. Specificaily, rn'o chemical kinetic mechanisms for n-heptane (NHPT) and three for biodiesel surrogates are investigated. In addition, the renormalization group (RNG) k-e (RANS) model is compared to the Smagorinsky based LES turbulence model. Using adaptive grid resoitttion, minimum grid sizes of 250 ßm and 125 ^m were obtained for the RANS and LES cases, respectively.Validations of these modeis were performed against experimental data from Sandia National Laboratories in a constant volume combustion chamber. Ignition deiay and flame lift-off validations were performed at different ambient temperature conditions. The LES model predicts lower ignition delays and qualitatively better flame structures compared to the RNG k-e model. The use of realistic chemistry and a ternary surrogate mixture, which consists of methyl decanoate, methyl nine-decenoate, and NHPT, results in better predicted LOLs and ignition deiays. For diesei fuei though, only marginal improvements are obsen'ed by using larger size mechanisms. However, these improved predictions come at a significant increase in computational cost.