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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 289 records · Page 16
All sourcesNASA NTRSDOE OSTI
NASA NTRS1990

CFD validation for aerodynamic flows - Challenge for the '90's

The process of computational fluid dynamics (CFD) validation is described from two perspectives, numerical error validation and physical model validation. Errors associated with time and space discretization, grid refinement, numerical dissipation, and level of solution convergence, are all possible sources of numerical error. The second aspect of CFD code validation is associated with the governing equations and the physical models, e.g., chemistry and turbulence models. This type of validation requires comparisons with carefully conducted experiments and is the primary aspect of the validation process discussed in this paper. Examples of validation are shown for selected Reynolds-averaged Navier-Stokes codes for conditions from transonic through hypersonic. Since code applications are becoming more complex, it no longer suffices to use data from surface or integral quantities alone to provide the required validation. Flow field surveys and experimental boundary condition measurements are emerging as critical data that must be obtained for CFD code validation. Progress in the overall level of validation is shown to be improving. However, future challenges remain, some of which are enumerated.

Marvin, Joseph G.↗
NASA NTRS1979

Equilibrium velocities of a planetesimal population

The random velocities of planetesimal populations specified by maximum and minimum masses and a power-law number density are calculated iteratively. The calculation is based on two different physical models involving ratios of rates: (1) excitation of kinetic energy by gravitational perturbation and elastic collision equal to damping of kinetic energy by inelastic collisions; and (2) excitation of kinetic energy a ratio b (about 3 usually) to doubling of mass. Both physical models are developed approximately and then more precisely. The approximate model (2) agrees with results of Safronov (1972). Both precise models are applied to populations approximating those generated by the calculations of Greenberg et al. (1978), Cox and Lewis (1979), and Wetherill (1979).

Kaula, W. M.↗
NASA NTRS2001

Diagnosing Tropical Divergent Circulations From Satellite-Derived Diabatic Forcing and Variational Integral Constraints

Large-scale divergent circulations are part of the atmospheric dynamic response to diabatic heating from condensation, radiative processes, and surface energy fluxes. Vertical motion and the associated divergent wind is thus intimately tied to the hydrologic cycle and the global beat balance. Despite its importance, the divergent circulation is too small in comparison to the rotational flow to measure directly with any accuracy. Vertical motions are recovered diagnostically from reanalyses and, as such, are subject to shortcomings in model physics, numerics, and data availability. While reanalysis estimates of tropical divergent circulations are much improved over those from the Global Weather Experiment, there are still substantial differences between products from operational centers. This is because these circulations are still forced largely by model physics and only secondarily by observations. In order to produce a refined estimate of tropical divergence and its interannual variability we have used a number of remotely-sensed data sets along with variational constraints to improve upon reanalysis estimates. Among these are: precipitation from SSM/I and GPCP, TOVS Path-A vertical cloud distributions; ISCCP radiative cooling rates; TOA radiative fluxes from ERBS, surface radiative fluxes from the SRB project, and surface latent and sensible flux estimates from SSM/I. The TOVS Path-A data constrain the divergent outflow in precipitating regions to have the same vertical structure as observed cloudiness. Using integral constraints for moisture, heat, and mass balance, we retrieve consistent divergent wind flows. We examine the ability of this type analysis to capture regional details of ENSO related perturbations to the divergent wind and associated tropical energy balance. Precipitation from satellite is found to be the major constraint in supplying this horizontal structure. We also consider the ability of this analysis to quantify integrated (land vs. ocean) fluctuations in the global monsoonal flow and energy balance. This depends, of course, on the error characteristics of the data constraints. Some estimate of these properties and their relative importance is provided.

Robertson, Franklin R.↗
DOE OSTI2024

Modern chemical graph theory

Abstract Graph theory has a long history in chemistry. Yet as the breadth and variety of chemical data is rapidly changing, so too do graph encoding methods and analyses that yield qualitative and quantitative insights. Using illustrative cases within a basic mathematical framework, we showcase modern chemical graph theory's utility in Chemists' analysis and model development toolkit. The encoding of both experimental and simulation data is discussed at various levels of granularity of information. This is followed by a discussion of the two major classes of graph theoretical analyses: identifying connectivity patterns and partitioning methods. Measures, metrics, descriptors, and topological indices are then introduced with an emphasis upon enhancing interpretability and incorporation into physical models. Challenging data cases are described that include strategies for studying time dependence. Throughout, we incorporate recent advancements in computer science and applied mathematics that are propelling chemical graph theory into new domains of chemical study. This article is categorized under: Molecular and Statistical Mechanics > Molecular Dynamics and Monte‐Carlo Methods Structure and Mechanism > Computational Materials Science Structure and Mechanism > Molecular Structures

Leite, Leonardo S. G.↗
DOE OSTI2026

Hybrid Oscillator-Qubit Quantum Processors: Instruction Set Architectures, Abstract Machine Models, and Applications

This tutorial offers a pedagogical guide to hybrid quantum processors that integrate discrete-variable (DV) qubits and continuous-variable (CV) oscillators. Aimed at computer scientists, engineers, and physicists, it provides an overview of the experimental, algorithmic, and architectural aspects of this novel and rapidly developing hardware model. Experimental realizations of this model include superconducting, trapped-ion, and neutral-atom platforms. By combining DV and CV components, hybrid oscillator-qubit processors enable a powerful new paradigm that offers complementary strengths for quantum control, error correction, computation, and simulation. Working toward the goal of a full-stack system connecting applications to CV-DV hardware, we define and formulate abstract machine models and instruction set architectures. These essential abstractions enable codesign of hardware and software, and resource estimation for exploring the potential of current and future hardware for computational and simulation tasks. Using these abstractions, we present both new and existing examples that illustrate the benefits of hybrid CV-DV processors relative to traditional DV-only hardware in computation as well as quantum simulation of physical models. Examples include algorithms for transferring states between DV and CV systems, performing the quantum Fourier transform, and simulation of lattice gauge theories. Relative to qubit-only hardware, the bosonic degrees of freedom natively available in hybrid architectures can substantially reduce the circuit complexity of simulations for physical models containing bosons. A key technique is the extension of quantum signal processing ideas to CV-DV systems. This work is intended to serve as a timely and comprehensive guide to this relatively unexplored yet promising approach to quantum computation and to provide a road map to guide future development.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS1984

Maximization of Growth Rates During Czochralski Pulling

It was suggested from theory(1-4) that silicon can be grown from the melt at rates far exceeding the current state of the art. Previous theoretical and experimental investigations which predict maximum rates of pulling during Czochralski growth are reviewed. Several experimental methods are proposed to modify the temperature distribution in a growing crystal to achieve higher rates of pulling. A physical model of a Czochralski crystal of germanium in contact with its melt was used to quantitatively determine, by direct measurement of the axial temperature distribution in the solid, the increase in axial temperature gradients effected by an inverted conical heat reflector located above the melt and coaxially about the physical model. Preliminary results indicate that this is an effective method of increasing the thermal resistance between the hot melt and crucible wall and a growing crystal. Under these conditions the enhancement of the interfacial temperature gradients permit a commensurate increase in the rate of crystal pulling.

Wargo, M. J.↗
NASA NTRSDate not supplied

Multidisciplinary Design Optimization of a Transonic Truss-Braced Wing using Physics-Based Models

Economic and environmental forces have placed pressure on the aviation industry to produce future aircraft designs with substantial improvements over those flying today. In order to meet these ambitious goals, new concepts such as the Transonic Truss-Braced Wing (TTBW) are being considered which diverge from the traditional tube-and-wing design. While this concept offers potential performance benefits over its traditional counterpart, it also features more coupling between various physics disciplines that must be considered during the design of the concept. This unique challenge provides a ripe opportunity for the application of multidisciplinary design optimization tool sets. The final work will couple together the mission analysis capability of Aviary with OpenAeroStruct for aerodynamic analysis and TACS for structural analysis. Using these tools we will preform a design optimization on the TTBW concept minimizing design fuel burn. The optimization will include design variables for mission trajectory, wing geometry, and structural sizing variables.

mbsae↗
NASA NTRS1999

Study of Magnetic Damping Effect on Convection and Solidification Under G-Jitter Conditions

As shown by NASA resources dedicated to measuring residual gravity (SAMS and OARE systems), g-jitter is a critical issue affecting space experiments on solidification processing of materials. This study aims to provide, through extensive numerical simulations and ground based experiments, an assessment of the use of magnetic fields in combination with microgravity to reduce the g-jitter induced convective flows in space processing systems. We have so far completed asymptotic analyses based on the analytical solutions for g-jitter driven flow and magnetic field damping effects for a simple one-dimensional parallel plate configuration, and developed both 2-D and 3-D numerical models for g-jitter driven flows in simple solidification systems with and without presence of an applied magnetic field. Numerical models have been checked with the analytical solutions and have been applied to simulate the convective flows and mass transfer using both synthetic g-jitter functions and the g-jitter data taken from space flight. Some useful findings have been obtained from the analyses and the modeling results. Some key points may be summarized as follows: (1) the amplitude of the oscillating velocity decreases at a rate inversely proportional to the g-jitter frequency and with an increase in the applied magnetic field; (2) the induced flow approximately oscillates at the same frequency as the affecting g-jitter, but out of a phase angle; (3) the phase angle is a complicated function of geometry, applied magnetic field, temperature gradient and frequency; (4) g-jitter driven flows exhibit a complex fluid flow pattern evolving in time; (5) the damping effect is more effective for low frequency flows; and (6) the applied magnetic field helps to reduce the variation of solutal distribution along the solid-liquid interface. Work in progress includes numerical simulations and ground-based measurements. Both 2-D and 3-D numerical simulations are being continued to obtain further information on g-jitter driven flows and magnetic field effects. A physical model for ground-based measurements is completed and some measurements of the oscillating convection are being taken on the physical model. The comparison of the measurements with numerical simulations is in progress. Additional work planned in the project will also involve extending the 2-D numerical model to include the solidification phenomena with the presence of both g-jitter and magnetic fields.

Li, Ben Q.↗
NASA NTRS1999

Rendering Three-Dimensional Solar Coronal Structures of Active Region 8227

Coronal X-ray and EUV synthesized images are constructed of Active Region 8227 (May-June 1996) and are compared with Yohkoh/SXT, SOHO/EIT, and TRACE observations. Using the rendering technique of Gary (1997) and Alexander, Gary, and Thompson (1998), specific geometric and physical models are used to integrated the plasma emission along the line of sight to obtain a rendered image. The specific instrumental profiles are convolved in the integration process as well as specific heating functions. We analyze coronal X-ray and EUV structures by constructing synthesized image and comparison with observations provide test of specific physical models. We investigate how different pressure distributions within the active region loop system affect the emission characteristics and compare the various results with coronal observations. We investigate how the different heating functions in the active region are reflected in the effect of overall structure of the region. Specific heating rates are tested.

Gary, G. A.↗
DOE OSTI2025

SAM Theory Manual

The System Analysis Module (SAM) is an advanced and modern system analysis tool under development at Argonne National Laboratory for advanced non-LWR reactor safety analysis. It aims to provide fast-running, modest-fidelity, whole-plant transient analyses capabilities, which are essential for fast turnaround design scoping and engineering analyses of advanced reactor concepts. While SAM is being developed as a system-level modeling and simulation tool, advanced modeling techniques being implemented include a reduced-order three-dimensional module, pseudo 3-D conjugate heat transfer modeling in reactor core, flexible and multi-scale modeling of heat transfer between fluid and structures, in addition to the advances in software environments and design, and numerical methods. SAM aims to be a generic system-level safety analysis tool for advanced non-LWRs, including Liquid-Metal-cooled fast Reactors (LMR), Molten Salt Reactors (MSR), Fluoride-salt-cooled High-temperature Reactors (FHR), and High-Temperature Gas-cooled Reactors (HTGR). SAM takes advantage of advances in physical modeling, numerical methods, and software engineering to enhance its user experience and usability. It utilizes an object-oriented computational framework (MOOSE), and its underlying meshing and finite-element library and linear and non-linear solvers, to leverage the modern advanced software environments and numerical methods. This document provides the theoretical and technical basis of the code to help users understand the underlying physical models (such as governing equations, closure models, and component models), system modeling approaches, numerical discretization and solution methods, and the overall capabilities in SAM. As new code capabilities and features are added, the SAM Theory Manual will be updated periodically to keep it consistent with the state of the development.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
NASA NTRS2014

Physics Based Model for Cryogenic Chilldown and Loading. Part IV: Code Structure

This is the fourth report in a series of technical reports that describe separated two-phase flow model application to the cryogenic loading operation. In this report we present the structure of the code. The code consists of five major modules: (1) geometry module; (2) solver; (3) material properties; (4) correlations; and finally (5) stability control module. The two key modules - solver and correlations - are further divided into a number of submodules. Most of the physics and knowledge databases related to the properties of cryogenic two-phase flow are included into the cryogenic correlations module. The functional form of those correlations is not well established and is a subject of extensive research. Multiple parametric forms for various correlations are currently available. Some of them are included into correlations module as will be described in details in a separate technical report. Here we describe the overall structure of the code and focus on the details of the solver and stability control modules.

cryogenic fluid management↗
NASA NTRS1991

Mixing and mixing enhancement in supersonic reacting flowfields

Propulsion systems planned for use late in this century and beyond will require appropriate physical models for describing supersonic combustion and numerical techniques for solving the model governing equations. A computer program to study these flows is reported which considers the multicomponent diffusion and convection of important chemical species, the finite-rate reaction of these species, and the resulting interaction of the field mechanics and the chemistry. The application of the program to a spatially developing and reacting mixing layer, which serves an an excellent physical model for the mixing and reaction processes that take place in a scramjet combustor, is reported. Several techniques to enhance the fuel-air mixing and growth of that layer and improve its overall combustion efficiency are considered.

Drummond, J. P.↗
NASA NTRS1976

Lunar motion analysis and laser data management

Work completed in lunar motion analysis and laser data management during the period July 1, 1971 - September 30, 1975 was reported. In this context, analysis refers to theoretical or numerical studies involving real or potential applications of such observations to improvement of the physical model, and data management refers to the process by which observed photon events are turned into observations and are made available to potential users. The data analysis work included: (1) bringing to operational status of computer programs for the numerical integration of the lunar orbit motion and for the application of lunar laser time delays for the improvement of the parameters of the physical model, (2) program improvement and program integrity, (3) three-dimensional ephemeris, and (4) miscellaneous independent studies. The data management work included: (1) data identification, (2) observatory interfaces, and (3) data distribution.

Mulholland, J. D.↗
DOE OSTI2024

Computational Analysis of Hydraulic Efficiency of Michigan DOT Cover C

Drainage structures are used to capture stormwater runoff in streets and highways in urban environments. These drainage structures, which typically consist of catch basins with grates, inlets, or combination grates/inlets, collect stormwater runoff and discharge through buried conveyance systems. They are strategically placed for public safety in curb and gutter systems to provide efficient drainage of water from roadways and thus reduce the risk of hydroplaning. The performance of drainage structures is measured in terms of hydraulic efficiency, which is defined as the percentage of flow captured by the basin as compared to the total flow drainage to the structure. Understanding of the performance of these drainage structures helps designers properly space inlets to promote an economic design that ensures the safety of the traveling public. The current design methodology used to determine drainage structure follows guidelines established in the current Michigan Department of Transportation (MDOT) Drainage Manual (2006). The guidelines in the MDOT Drainage Manual were modeled after the Federal Highway Administration’s (FHWA) Hydraulic Engineering Circular 22 “Urban Drainage Design” (HEC-22). HEC-22 includes empirically derived equations to calculate the interception capacity of drainage structures for several commonly used grate configurations, such as the parallel bar, curved vane and tilt bar grates, which are based on a research study performed by Burgi et al. in the 1970s. MDOT uses several drainage structures to capture runoff that are detailed as Standard Plans. Many of these drainage structures utilize sinusoidal type grates that are not described in HEC-22. Physical modeling of these structures has been limited, posing the need to have them analyzed to verify their capture efficiency. Current MDOT practice is to assume a similar sized reticuline grate, as described in HEC-22, for capture efficiencies. Until recently, evaluating the hydraulic performance of drainage structures was limited to physical modeling in a hydraulics laboratory. With advances in engineering software and computing power, computational fluid dynamics (CFD) modeling has become a more cost-effective alternative. The Federal Highway Administration (FHWA) provides states the option to evaluate their drainage structures using CFD through the Transportation Pooled Fund Program. This study, “Computational Analysis of Hydraulic Efficiency of Michigan DOT Cover C,” was carried out using the pooled fund. MDOT’s Cover C was chosen as the first test candidate, given its similar sinusoidal pattern to other MDOT grates, but it is typically used for high-volume, higher speed applications. A similar version, Cover CX, is used on interstate highways but does not have traverse bars for bicycle safety. Additional grates may be considered for evaluation in the future.

42 ENGINEERING↗
NASA NTRS1994

Efficient Updating of Model Parameters Using Modal Coordinates

Model correlation methods based on iterative modification of physical model parameters have been used with frequent success. The cost and time to perform these methods is driven mostly by the need to recompute normal modes and parameter sensitivities from the full finite element model after each adjustment.

modal↗
NASA NTRSDate not supplied

Physics and Modeling of Quasi-Steady and Forced Shock Trains

The dual-mode scramjet is a propulsive concept for contemporary hypersonic vehicles promising flight cruise speeds upwards of Mach 5. Despite decades of development and a recent resurgence in interest, such engines are not routinely deployed for commercial or military purposes. Instead, they have been confined to the realm of ground-test research and limited one-off flight test missions. One of the key stumbling blocks on the critical path to deployment of a dual-mode scramjet is the optimal design and stable operation of the isolator, a typically constant area duct that separates the scramjet inlet from the combustor. During ramjet mode at Mach numbers from 3 to 5 and during the transition to scramjet mode at higher Mach numbers, the isolator contains the pseudo-shock. Necessary to meet the back-pressure in the combustor, the pseudo-shock is typically divided into a shock dominated shock train region followed by a turbulence driven mixing region. Fluctuations in combustor pressure due to vehicle maneuvering, throttling, or combustion instabilities drive the shock train to shift streamwise within the isolator. In response to sharp pressure fluctuations, the shock train is unable to stabilize within the isolator, and the scramjet unstarts by ejecting the shock train out the inlet. This work addresses three key gaps in understanding of the isolator pseudo-shock. The phenomenon is studied in three experimental facilities to investigate the quasi-steady and unsteady fluid dynamics of the shock train in fueled and un-fueled test conditions. The strong link between boundary layer morphology and shock train structure is studied in detail and used as a tool to evaluate the state-of-the-art definitions and models of the pseudo-shock. Identifying the limitations of these models, a new process driven flux-conserved pseudo-shock model is proposed. This provides a computationally efficient model grounded in the fluid dynamic mechanisms of the pseudo-shock with better predictive capability than the current state-of-the-art across all facilities tested. The unsteady behavior of the shock train is further investigated to identify and understand two distinct forced dynamic modes: mechanically induced, low-rate forcing and high-rate combustion driven unsteadiness that sheds upstream propagating shocks. The proposed process driven model is found to be effective in the the limiting case of high-rate combustion driven unsteadiness by evaluating the model in a shock stationary reference frame. Further analysis identifies the approximately rigid chain motion of the shock train structure to mechanically induced forcing. The time delay between the onset of forced dynamics is found to saturate to a constant value and maximum shock train speed along the isolator with respect to the perturbation rate of change. The result of this work provides dual-mode scramjet designers with improved tools and physical understanding to develop more efficient, robust, and capable propulsion systems for hypersonic vehicles.

JAXA↗
NASA NTRS1998

Numerical Modeling of Physical Vapor Transport in Contactless Crystal Growth Geometry

Growth from the vapor under conditions of limited contact with the walls of the growth ampoule is beneficial for the quality of the growing crystal due to reduced stress and contamination which may be caused by interactions with the growth container. The technique may be of a particular interest for studies on crystal growth under microgravity conditions: elimination of some factors affecting the crystal quality may make interpretation of space-conducted processes more conclusive and meaningful. For that reason, and as a part of our continuing studies on 'contactless' growth technique, we have developed a computational model of crystal growth process in such system. The theoretical model was built, and simulations were performed using the commercial computational fluid dynamics code, (CFD) ACE. The code uses an implicit finite volume formulation with a gray discrete ordinate method radiation model which accounts for the diffuse absorption and reflection of radiation throughout the furnace. The three-dimensional model computes the heat transfer through the crystal, quartz, and gas both inside and outside the ampoule, and mass transport from the source to the crystal and the sink. The heat transport mechanisms by conduction, natural convection, and radiation, and mass transport by diffusion and convection are modeled simultaneously and include the heat of the phase transition at the solid-vapor interfaces. As the thermal boundary condition, temperature profile along the walls of the furnace is used. For different thermal profiles and furnace and ampoule dimensions, the crystal growth rate and development of the crystal-vapor and source-vapor interfaces (change of the interface shape and location with time) are obtained. Super/under-saturation in the ampoule is determined and critical factors determining the 'contactless' growth conditions are identified and discussed. The relative importance of the ampoule dimensions and geometry, the furnace dimensions and its temperature, and the properties of the grown material are analyzed. The results of the simulations are compared with related experimental results on growth of CdTe, CdZnTe, ZnTe, PbTe, and PbSnTe crystals by this technique.

Palosz, W.↗
NASA NTRS1984

Vectorized Monte Carlo methods for reactor lattice analysis

Some of the new computational methods and equivalent mathematical representations of physics models used in the MCV code, a vectorized continuous-enery Monte Carlo code for use on the CYBER-205 computer are discussed. While the principal application of MCV is the neutronics analysis of repeating reactor lattices, the new methods used in MCV should be generally useful for vectorizing Monte Carlo for other applications. For background, a brief overview of the vector processing features of the CYBER-205 is included, followed by a discussion of the fundamentals of Monte Carlo vectorization. The physics models used in the MCV vectorized Monte Carlo code are then summarized. The new methods used in scattering analysis are presented along with details of several key, highly specialized computational routines. Finally, speedups relative to CDC-7600 scalar Monte Carlo are discussed.

Brown, F. B.↗