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Molecular diffusion and phase stability in high-pressure combustion

Abstract The increased modeling complexity needed to simulate high-pressure combustion in rocket engines results in significant computational costs–costs which are not always justified for engineering applications. Multicomponent diffusion computations are… Click to show full abstract

Abstract The increased modeling complexity needed to simulate high-pressure combustion in rocket engines results in significant computational costs–costs which are not always justified for engineering applications. Multicomponent diffusion computations are at least 40% more expensive than the constant Lewis number diffusion assumption for the simplest hydrogen/oxygen combustion; the computational penalty increases rapidly with the number of species under consideration. The higher-fidelity diffusion modeling is justified in cryogenic fuel combustion if it affects the phase-stability of the propellants. We investigate the impact of the mixture averaged, multicomponent, and constant Lewis number diffusion models of a laminar counterflow flame at trans- and supercritical conditions for typical rocket propellants, namely: hydrogen, methane, and kerosene. Using vapor liquid equilibrium (VLE) theory, we show that, even in the limit cases, the mass diffusion model has a limited effect on the phase stability and pseudo-phase change of the propellants; the majority of the differential diffusion errors are located in the high temperature/ideal gas regions of the flame. The differential diffusion error due to real fluid thermodynamics is at most about 20% of the differential diffusion error which occurs in the ideal gas region of the flame. As a result, the impact of the differential diffusion remains similar to low-pressure combustion conditions, thus supporting the use of engineering-level simplifications for the simulation of these complex high-pressure reactive flows.

Keywords: pressure combustion; diffusion; combustion; high pressure; phase stability

Journal Title: Combustion and Flame
Year Published: 2019

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