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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 271 records · Page 15
All sourcesNASA NTRSDOE OSTI
NASA NTRS1989

A set of strongly coupled, upwind algorithms for computing flows in chemical nonequilibrium

Two new algorithms have been developed to predict the flow of viscous, hypersonic, chemically reacting gases over three-dimensional bodies. Both take advantage of the benefits of upwind differencing, Total Variation Diminishing (TVD) techniques and of a finite-volume framework, but obtain their solution in two separate manners. The first algorithym is a time-marching scheme, and is generally used to obtain solutions in the subsonic portions of the flow field. The second algorithm is a much less expensive, space-marching scheme and can be used for the computation of the larger, supersonic portion of the flow field. Both codes compute their interface fluxes with a new temporal Riemann solver and the resulting schemes are made fully implicit including the chemical source terms.

Molvik, Gregory A.↗
NASA NTRS1995

Development of an upwind, finite-volume code with finite-rate chemistry

Under this grant, two numerical algorithms were developed to predict the flow of viscous, hypersonic, chemically reacting gases over three-dimensional bodies. Both algorithms take advantage of the benefits of upwind differencing, total variation diminishing techniques and of a finite-volume framework, but obtain their solution in two separate manners. The first algorithm is a zonal, time-marching scheme, and is generally used to obtain solutions in the subsonic portions of the flow field. The second algorithm is a much less expensive, space-marching scheme and can be used for the computation of the larger, supersonic portion of the flow field. Both codes compute their interface fluxes with a temporal Riemann solver and the resulting schemes are made fully implicit including the chemical source terms and boundary conditions. Strong coupling is used between the fluid dynamic, chemical and turbulence equations. These codes have been validated on numerous hypersonic test cases and have provided excellent comparison with existing data. This report summarizes the research that took place from August 1,1994 to January 1, 1995.

Molvik, Gregory A.↗
NASA NTRS1989

Numerical simulation of unsteady flows generated by dissociating nitrogen diffusion

An explicit time accurate predictor-corrector scheme, similar to MacCormack's, has been used to simulate unsteady nonequilibrium laminar chemically-reacting diffusion-reaction generated flows. A zonal approach, along with nonstructured boundaries, allows computation of internal and external flow with the same computer code. Results for equilibrium flows generated by dissociating, vibrationally relaxing nitrogen in a rectangular chamber are presented. The unsteady flows were generated strictly by the chemical reactions and concentration gradients.

Marraffa, Lionel↗
NASA NTRS2019

Effects of Wall Cooling on Supersonic Modes in High-Enthalpy Hypersonic Boundary Layers over a Cone

High-enthalpy hypersonic boundary-layer transition plays an important role in many entry/descent vehicles. Aerothermodynamic performance of these vehicles strongly depends on the transition location on the surface. However, detailed transition flow physics in these chemically reacting boundary layers are poorly understood and transition estimates during the design phase rely heavily on empirically-derived transition criteria such as 𝑹𝒆(𝜽)/𝑴(𝒆). One of the most intriguing characteristics in hypersonic boundary layers is the presence of unstable supersonic modes, first identified in the 1990s. Due to a recent surge in hypersonic applications, there has been renewed interest in studying the flow physics of supersonic modes using either theory or direct numerical simulations. This paper investigates the rise of supersonic modes in a high-enthalpy hypersonic flow over a 𝟓° half-angle cone at various wall temperatures using both quasiparallel linear stability theory and linear PSE. It was found that supersonic modes exist in all wall temperature conditions including the adiabatic wall case. Cooler wall temperature causes the second Mack mode to become an unstable supersonic mode naturally downstream of the upper-branch neutral location when the wall is sufficiently cooled. In terms of the integrated growth, the second mode is still the dominant mode. Nonetheless, supersonic modes can cause additional series of relatively weaker growth than that of the second mode beyond the peak amplitude location. According to the present linear PSE results, contrary to what was speculated in the literature, supersonic-mode pressure disturbance structure radiated into the freestream is nonacoustic in nature and the formation of unstable supersonic modes is mainly associated with the synchronization of phase speed between the instability and acoustic waves in a nonp ayer, not due to nonlinear modal interaction as suggested in the literature.

Chang, Chau-Lyan↗
NASA NTRS1984

A model for reaction rates in turbulent reacting flows

To account for the turbulent temperature and species-concentration fluctuations, a model is presented on the effects of chemical reaction rates in computer analyses of turbulent reacting flows. The model results in two parameters which multiply the terms in the reaction-rate equations. For these two parameters, graphs are presented as functions of the mean values and intensity of the turbulent fluctuations of the temperature and species concentrations. These graphs will facilitate incorporation of the model into existing computer programs which describe turbulent reacting flows. When the model was used in a two-dimensional parabolic-flow computer code to predict the behavior of an experimental, supersonic hydrogen jet burning in air, some improvement in agreement with the experimental data was obtained in the far field in the region near the jet centerline. Recommendations are included for further improvement of the model and for additional comparisons with experimental data.

Chinitz, W.↗
NASA NTRS1987

Vortex-scalar element calculations of a diffusion flame stabilized on a plane mixing layer

The vortex-scalar element method, a scheme which utilizes vortex elements to discretize the region of high vorticity and scalar elements to represent species or temperature fields, is utilized in the numerical simulations of a two-dimensional reacting mixing layer. Computations are performed for a diffusion flame at high Reynolds and Peclet numbers without resorting to turbulence models. In the nonreacting flow, the mean and fluctuation profiles of a conserved scalar show good agreement with experimental measurements. Results for the reacting flow indicate that for temperature independent kinetics, the chemical reaction begins immediately downstream of the splitter plate where mixing starts. Results for the reacting flow with Arrhenius kinetics show an ignition delay, which depends on reactant temperature, before significant chemical reaction occurs. Harmonic forcing changes the structure of the layer, and concomitantly the rates of mixing and reaction, in accordance with experimental results. Strong stretch within the braids in the nonequilibrium kinetics case causes local flame quenching due to the temperature drop associated with the large convective fluxes.

Ghoniem, Ahmed F.↗
DOE OSTI2022

Autoencoder Neural Network for chemically reacting systems

Incorporating detailed chemical kinetic models is critical for accurate simulations of reacting flows. However, detailed models involve a large number of thermochemical (TC) state variables. Solving the governing equations to evolve these TC variables becomes impractical for real-world applications. In this work, we propose an autoencoder (AE) neural network (NN)-based reduced model to accelerate such simulations. The AE NN is first trained to find a low-dimensional latent representation of the TC states. Then, the evolving state of a chemical system can be tracked by solving the equations of the latent variables instead of the original TC equations. We demonstrate the reduced model in a syngas CO/H 2 combustion system, using training data collected from canonical perfectly stirred reactors (PSRs). It is found that the AE model can reduce the dimension of the combustion system from 12 to 2 while maintaining low reconstruction error and excellent elemental mass conservation for the test dataset. In the a posteriori test, the combustion states obtained from solving the two latent equations are compared to those from solving the 12 equations of the full model. The AE reduced method is found to be able to capture the diverse combustion states on the top two branches of the S-curve well including the extinction turning point, but with higher prediction errors for states near the ignition turning point.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2022

Tools for Design and Scale-Up of Solar Thermochemical Reactors: Cooperative Research and Development Final Report, CRADA Number CRD-13-00530

NREL will be collaborating with the Participant on a United States - Australia Solar Energy Collaboration (USASEC) Project Number 1-USO034 "Tools for design and scale-up of solar thermochemical reactors." The grant funds for the Participant's 3.5 year project number 1-US034 commencing on 1 February 2013 have been awarded to the Participant by the Australian Renewable Energy Agency and NREL will be collaborating with the Participant during the final 28 months of this project. This project seeks to provide basic knowledge required to design solar thermochemical reactors able to perform the required energy conversions. In several proposed and demonstrated reactors, concentrated sunlight directly irradiates small solid particles suspended in fluid, enabling very high heat transfer rates to the particles which are the sites of chemical reaction. The reactors, therefore, involve the complex and couple dynamics of turbulent, chemically reacting, particle-laden flows and their interaction with concentrating solar radiation. A strong understanding of these coupled interactions will be crucial important in predicting and optimizing the performance of prototype reactors, but this understanding does not yet exist, since they have never been studied in any fundamental way. The project has a assembled an internationally leading team from The University of New South Wales (UNSW) and the University of Adelaide in Australia and the NREL in the United States to address this key gap in available know-how. The project will use U.S. Dept. of Energy (DOE) supercomputers, among the most powerful available worldwide, with cutting-edge software tools to perform first-principles simulations of the relevant interactions. These studies will be combined with detailed laser-based measurements in Australia to provide the first comprehensive databases concerning the governing phenomena in directly irradiated solar-thermochemical reactors. The outcomes will be the basic scientific knowledge, engineering knowhow and modeling tools necessary to design new reactor concepts and then scale up from the laboratory bench to practical size systems.

14 SOLAR ENERGY↗
NASA NTRS1992

Comments on PDF methods

Viewgraphs are presented on the following topics: the grand challenge of combustion engineering; research of probability density function (PDF) methods at Sandia; experiments of turbulent jet flames (Masri and Dibble, 1988); departures from chemical equilibrium; modeling turbulent reacting flows; superequilibrium OH radical; pdf modeling of turbulent jet flames; scatter plot for CH4 (methane) and O2 (oxygen); methanol turbulent jet flames; comparisons between predictions and experimental data; and turbulent C2H4 jet flames.

Chen, J.-Y.↗
NASA NTRS1995

The effects of sooting in droplet combustion

The study of the burning of a single droplet is an ideal problem from which to gain fundamental understanding of diffusion flame characteristics. Droplet combustion is a complex physico-chemical process that involves a chemically-reacting two-phase flow with phase changes and yet simple experiments and analysis can be used to attain important insights into the burning rate, flame dynamics, kinetic extinction and disruption processes. It is a subject that has been actively studied for the past 40 years with most of the fundamental experiments being performed under reduced-gravity conditions for direct comparisons with theoretical/computational analyses that invoke spherical symmetry assumptions. In the earlier studies, the effects of sooting on the overall burning characteristics were not considered. However, recent microgravity investigations performed at the NASA-LeRC droptowers (Droplet Combustion Experiment) and others indicate that effects of soot and sootcloud formation may be significant during the lifetime of the droplet and therefore must be included in the analysis.

Lee, Kyeong-Ook↗
NASA NTRS1996

TPS Sizing for Access-to-Space Vehicles

A study was carried out to identify, develop, and benchmark simulation techniques needed for optimum thermal protection system (TPS) material selection and sizing for reusable launch vehicles. Fully viscous, chemically reacting, Navier-Stokes flow solutions over the Langley wing-body single stage to orbit (SSTO) configuration were generated and coupled with an in-depth conduction code. Results from the study provide detailed TPS heat shield materials selection and thickness sizing for the wing-body SSTO. These results are the first ever achieved through the use of a complete, trajectory based hypersonic, Navier-Stokes solution database. TPS designs were obtained for both laminar and turbulent entry trajectories using the Access-to-Space baseline materials such as tailorable advanced blanket insulation. The TPS design effects (materials selection and thickness) of coupling material characteristics to the aerothermal environment are illustrated. Finally, a sample validation case using the shuttle flight database is included.

Henline, William↗
NASA NTRS1992

Computational method to predict thermodynamic, transport, and flow properties for the modified Langley 8-foot high-temperature tunnel

The Langley 8 foot high temperature tunnel (8 ft HTT) is used to test components of hypersonic vehicles for aerothermal loads definition and structural component verification. The test medium of the 8 ft HTT is obtained by burning a mixture of methane and air under high pressure; the combustion products are expanded through an axisymmetric conical contoured nozzle to simulate atmospheric flight at Mach 7. This facility was modified to raise the oxygen content of the test medium to match that of air and to include Mach 4 and Mach 5 capabilities. These modifications will facilitate the testing of hypersonic air breathing propulsion systems for a wide range of flight conditions. A computational method to predict the thermodynamic, transport, and flow properties of the equilibrium chemically reacting oxygen enriched methane-air combustion products was implemented in a computer code. This code calculates the fuel, air, and oxygen mass flow rates and test section flow properties for Mach 7, 5, and 4 nozzle configurations for given combustor and mixer conditions. Salient features of the 8 ft HTT are described, and some of the predicted tunnel operational characteristics are presented in the carpet plots to assist users in preparing test plans.

Venkateswaran, S.↗
NASA NTRS2005

Incorporation of a Chemical Equilibrium Equation of State into LOCI-Chem

Renewed interest in development of advanced high-speed transport, reentry vehicles and propulsion systems has led to a resurgence of research into high speed aerodynamics. As this flow regime is typically dominated by hot reacting gaseous flow, efficient models for the characteristic chemical activity are necessary for accurate and cost effective analysis and design of aerodynamic vehicles that transit this regime. The LOCI-Chem code recently developed by Ed Luke at Mississippi State University for NASA/MSFC and used by NASA/MSFC and SSC represents an important step in providing an accurate, efficient computational tool for the simulation of reacting flows through the use of finite-rate kinetics [3]. Finite rate chemistry however, requires the solution of an additional N-1 species mass conservation equations with source terms involving reaction kinetics that are not fully understood. In the equilibrium limit, where the reaction rates approach infinity, these equations become very stiff. Through the use of the assumption of local chemical equilibrium the set of governing equations is reduced back to the usual gas dynamic equations, and thus requires less computation, while still allowing for the inclusion of reacting flow phenomenology. The incorporation of a chemical equilibrium equation of state module into the LOCI-Chem code was the primary objective of the current research. The major goals of the project were: (1) the development of a chemical equilibrium composition solver, and (2) the incorporation of chemical equilibrium solver into LOCI-Chem. Due to time and resource constraints, code optimization was not considered unless it was important to the proper functioning of the code.

Cox, Carey F.↗
NASA NTRS1995

Modeling of turbulent chemical reaction

Viewgraphs are presented on modeling turbulent reacting flows, regimes of turbulent combustion, regimes of premixed and regimes of non-premixed turbulent combustion, chemical closure models, flamelet model, conditional moment closure (CMC), NO(x) emissions from turbulent H2 jet flames, probability density function (PDF), departures from chemical equilibrium, mixing models for PDF methods, comparison of predicted and measured H2O mass fractions in turbulent nonpremixed jet flames, experimental evidence of preferential diffusion in turbulent jet flames, and computation of turbulent reacting flows.

Chen, J.-Y.↗
NASA NTRS1978

Turbulent viscous shock layer solutions for Jovian entry at small angles of attack

The equations governing the laminar and turbulent flows of reacting gas mixtures in chemical equilibrium over axially symmetric blunt bodies at small angles of attack are developed and presented in the unsteady conservative form. Solutions are obtained in the planes of symmetry of the flow field for the typical conditions encountered by a probe entering the Jovian atmosphere at small angles of attack. The eddy-viscosity is approximated by a two-layer model. The shock wave is treated as a discontinuity across which the shock relations are used to compute the flow conditions behind the shock. A time-asymptotic finite-difference method is used to solve the equations. The zero angle of attack results for a hyperboloid are compared with the existing results but neither experimental nor computational results are available for comparison with the present results at angle of attack.

Jumar, A.↗
NASA NTRS1989

Progress in computing nozzle/plume flow fields

The long-term goal is to develop the capability to predict chemically-reacting, multi-stream nozzle and plume flow fields. Two basic Navier-Stokes solvers, including the widely used F-3D code, are upgraded to include several upwind difference schemes and portable chemistry packages. Current computational capabilities for solving equilibrium single-stream and multi-stream, frozen gas, and finite rate chemistry problems are described. A variety of complex nozzle and plume flows were computed. Solutions presented include axisymmetric plume flow for ideal and equilibrium air, 3-D NASP nozzle/afterbody flow, and an internal nozzle calculation comparing various finite-rate chemistry packages.

Ruffin, Stephen M.↗
NASA NTRS1972

Numerical solutions of several reflected shock-wave flow fields with nonequilibrium chemical reactions

The method of characteristics for a chemically reacting gas is used in the construction of the time-dependent, one-dimensional flow field resulting from the normal reflection of an incident shock wave at the end wall of a shock tube. Nonequilibrium chemical reactions are allowed behind both the incident and reflected shock waves. All the solutions are evaluated for oxygen, but the results are generally representative of any inviscid, nonconducting, and nonradiating diatomic gas. The solutions clearly show that: (1) both the incident- and reflected-shock chemical relaxation times are important in governing the time to attain steady state thermodynamic properties; and (2) adjacent to the end wall, an excess-entropy layer develops wherein the steady state values of all the thermodynamic variables except pressure differ significantly from their corresponding Rankine-Hugoniot equilibrium values.

Hanson, R. K.↗
NASA NTRS1991

Stability of low-speed reacting flows

Small perturbation, linear, inviscid stability theory is developed and applied to coflowing chemically reacting jets. A necessary condition for the existence of axisymmetric and azimuthal instabilities is derived. The eigenfunction structure provides considerable insight into the underlying physical mechanism. In nonpremixed cases, high temperature tends to occur in regions where the shear layer tries to roll up; this reduces the available momentum, suppressing the growth of instabilties. It is found that chemical reaction during the growth of instabilities is unimportant, suggesting that this effect could be ignored in a viscous theory. Both nonpremixed and premixed flames in axisymmetric shear layers are generally more stable to small perturbations than in the corresponding cold case. However, while for nonpremixed flames the frequency of the most amplified wave decreases with increasing heat release, the opposite occurs for premixed cases.

Mahalingham, S.↗