Development and applications of numerical methods devoted to reactive interface simulations are presented. Emphasis is put on vaporization, where numerical difficulties arise in imposing accurate jump conditions for heat and mass transfers. We use both the Level Set Method and the Ghost Fluid Method to capture the interface motion accurately and to handle suitable jump conditions. A local vapor...

We report measurements of turbulent heat transport in samples of ethane (C2H6) heated from below while the applied temperature difference DeltaT straddled the liquid-vapor coexistence curve T(phi)(P). When the sample top temperature T(t) decreased below T(phi), droplet condensation occurred and the latent heat of vaporization H provided an additional heat-transport mechanism. The effective cond...

[1] Interaction between impact-induced vapor clouds and the ambient atmosphere may play an important role in planetary evolution. In the companion study, Sugita and Schultz [2003] conducted a series of impact experiments detailing observation of this interaction process. The laboratory experiments using diatomic molecular spectroscopy provide several well-defined observational constraints on th...

The effects of in-cylinder water injection on a direct injection (DI) Diesel engine were studied using a computational fluid dynamics (CFD) program based on the Kiva-3v code. The spray model is validated against experimental bomb data with good agreement for vapor penetration as a function of time. It was found that liquid penetration increased approximately 35% with 23% of the fuel volume repl...

A molecular-orbital derived polarizable potential function is developed to model liquid and supercritical fluid hydrogen fluoride. The model is based on a novel application of a combined quantum-mechanical and molecular-mechanical ~QM/MM! approach, which treats molecular polarization by a semiempirical method. Two geometrical models are examined, differing in the intramolecular bond length for ...