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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 559 records · Page 31
All sourcesNASA NTRSDOE OSTI
NASA NTRS1985

Digital fringe reduction techniques applied to the measurement of three-dimensional transonic flow fields

A system for digital inteferogram evaluation based on an image-processing system connected to a host computer has been implemented. The system supports one- and two-dimensional interferogram evaluations. Interferograms are digitized, enhanced, and segmented. The fringe coordinates are extracted, and the fringes are represented as polygon data structures. Fringe numbering and fringe interpolation modules are implemented. The system supports editing and interactive features as well as graphic visualization. An application of the system to the evaluation of double exposure interferograms from the transonic flow field around a helicopter blade and the reconstruction of the 3-D flow field are given.

Becker, F.↗
NASA NTRS1987

Application of digital interferogram evaluation techniques to the measurement of 3-D flow fields

A system for digitally evaluating interferograms, based on an image processing system connected to a host computer, was implemented. The system supports one- and two-dimensional interferogram evaluations. Interferograms are digitized, enhanced, and then segmented. The fringe coordinates are extracted, and the fringes are represented as polygonal data structures. Fringe numbering and fringe interpolation modules are implemented. The system supports editing and interactive features, as well as graphic visualization. An application of the system to the evaluation of double exposure interferograms from the transonic flow field around a helicopter blade and the reconstruction of the three dimensional flow field is given.

Becker, Friedhelm↗
NASA NTRS1987

Expert systems relations in space applications

The problem of expert systems relations as they pertain to space applications is discussed. First, these systems are categorized and the relationships between them are analyzed. Then, the expert systems cooperation paradigm is proposed. This paradigm addresses various types of communication and coordination issues in an attempt to create a general model applicable in a number of situations.

Brady, Michael↗
NASA NTRS1989

The transient behavior of weldpools with a deformed free surface

Transient heat transfer, fluid flow and phase change in a weldpool with a deformed free surface are modeled using a two-dimensional coordinate transfornmation. The theoretical approach makes it possible to accurately model high Marangoni number flows even when the free surface is not horizontal. The method is used to examine the role of surface deformation and surface tension forces in controlling weld penetration during cathode spot welding of steel and aluminum. The calculated flow fields, temperature distributions and weldpool shapes are consistent with experimental findings, and are in reasonable agreement with previously published modeling efforts.

Thompson, M. E.↗
NASA NTRS1991

An intrinsically n-dimensional generalized flux vector splitting implicit finite element Euler algorithm

A generalized flux-vector splitting implicit Galerkin finite-element algorithm for the Euler equations in curvilinear coordinates for ideal and reacting gases is derived. For an arbitrary equation of state, the curvilinear-coordinate flux vector is split in kinematic and kinetic components, and the associated jacobian matrix eigenvalues explicitly depend on the metric data. After directional semidiscretization, the terminal ordinary differential-equation system is solved via a nonlinearly stable implicit Runge-Kutta scheme in concert with an accurate tensor matrix product factorization. The results for selected two-dimensional supersonic and axisymmetric hypersonic flows validate the algorithm and verify its robustness for curvilinear-coordinate computations. The evolution towards a steady state is achieved for large Courant numbers without indication of numerical instabilities.

Iannelli, G. S.↗
NASA NTRS1999

Soil Organic Carbon and Below Ground Biomass: Development of New GLOBE Special Measurements

A scientific consensus is building that changes in the atmospheric concentrations of radiatively active gases are changing the climate (IPCC, 1990). One of these gases CO2 has been increasing in concentration due to additions from anthropogenic sources that are primarily industrial and land use related. The soil contains a very large pool of carbon, estimated at 1550 Gt (Lal 1995) which is larger than the atmospheric and biosphere pools of carbon combined (Greenland, 1995). The flux between the soil and the atmosphere is very large, 60 Pg C/yr (Lal 1997), and is especially important because the soil can act as either a source or a sink for carbon. On any given landscape, as much as 50% of the biomass that provides the major source of carbon can be below ground. In addition, the movement of carbon in and out of the soil is mediated by the living organisms. At present, there is no widespread sampling of soil biomass in any consistent or coordinated manner. Current large scale estimates of soil carbon are limited by the number and widely dispersed nature of the data points available. A measurement of the amount of carbon in the soil would supplement existing carbon data bases as well as provide a benchmark that can be used to determine whether the soil is storing carbon or releasing it to the atmosphere. Information on the below ground biomass would be a valuable addition to our understanding of net primary productivity and standing biomass. The addition of these as special measurements within GLOBE would be unique in terms of areal extent and continuity, and make a real contribution to scientific understanding of carbon dynamics.

Levine, Elissa↗
NASA NTRS2003

The Temporal Configuration of Airline Networks

The deregulation of US aviation in 1978 resulted in the reconfiguration of airline networks into hub-and-spoke systems, spatially concentrated around a small number of central airports or 'hubs' through which an airline operates a number of daily waves of flights. A hub-and-spoke network requires a concentration of traffic in both space and time. In contrast to the U.S. airlines, European airlines had entered the phase of spatial network concentration long before deregulation. Bilateral negotiation of traffic fights between governments forced European airlines to focus their networks spatially on small number of 'national' airports. In general, these star-shaped networks were not coordinated in time. Transfer opportunities at central airports were mostly created 'by accident'. With the deregulation of the EU air transport market from 1988 on, a second phase of airline network concentration started. European airlines concentrated their networks in time by adopting or intensifying wave-system structures in their flight schedules. Temporal concentration may increase the competitive position of the network in a deregulated market because of certain cost and demand advantages.

Burghouwt, Guillaume↗
NASA NTRS2014

Section 508 Electronic Information Accessibility Requirements for Software Development

Section 508 Subpart B 1194.21 outlines requirements for operating system and software development in order to create a product that is accessible to users with various disabilities. This portion of Section 508 contains a variety of standards to enable those using assistive technology and with visual, hearing, cognitive and motor difficulties to access all information provided in software. The focus on requirements was limited to the Microsoft Windows® operating system as it is the predominant operating system used at this center. Compliance with this portion of the requirements can be obtained by integrating the requirements into the software development cycle early and by remediating issues in legacy software if possible. There are certain circumstances with software that may arise necessitating an exemption from these requirements, such as design or engineering software using dynamically changing graphics or numbers to convey information. These exceptions can be discussed with the Section 508 Coordinator and another method of accommodation used.

Pathways↗
NASA NTRSDate not supplied

Evaluation of CFD as a Surrogate for Mach 2.4 to 4.6 Wind-Tunnel Testing – Project Overview

The debate over when wind-tunnel testing will be replaced by Computational Fluid Dynamics (CFD) comes and goes. More recently the debate has subsided with a more collaborative spirit between practitioners of these two disciplines resulting in significant improvements in the outcomes of both. There may come a time, however, when CFD has sufficient accuracy to supplant WTT as the dominant or perhaps only tool for aerodynamic simulation. If and/or when that happens, financial pressures favor efforts to close or severely limit the operations of wind tunnels. Presumably additional resources will go toward CFD to generate aerodynamic databases, load environments, and new aero/fluid-dynamic knowledge. It is therefore important to develop appropriate processes by which wind-tunnel closure decisions are made to ensure that facilities critical to industry and government research and development aren’t closed prematurely without proof that the available CFD tools have sufficient accuracy and low-enough cost (and enough experts and computational facilities) to take on the traditional role of wind tunnels. This paper will describe a project intended to answer the specific question of whether CFD can replace wind-tunnel testing for the limited Mach-number range 2.4 to 4.6. The project involves wind-tunnel testing and coordinated CFD for a variety of vehicle and flow-physics types in the high-speed leg of the Unitary Plan Wind Tunnel at NASA’s Langley Research Center.

James C Ross↗
NASA NTRS2021

Deriving Mercury Geodetic Parameters with Altimetric Crossovers from the Mercury Laser Altimeter (MLA)

Based on the previous applications of laser altimetry to planetary geodesy at GSFC, we use the recently developed PyXover software package to analyze altimetric crossovers from the Mercury Laser Altimeter (MLA). Using PyXover, we place new constraints on Mercury's geodetic parameters via least squares minimization of crossover discrepancies. We simultaneously solve for orbital corrections for each MLA ground track, for the geodetic parameters of the International Astronomical Union-recommended orientation model for Mercury (pole right-ascension and declination coordinates, prime meridian rotation rate, and librations), and for the Mercury's Love number h2. We calibrate the formal errors of our solution based on closed-loop simulations and on the level of robustness against a priori values, data selection, and parametrization. Our solution of the Mercury's rotational parameters is consistent with published values. In particular, our new estimate for the orientation of the pole places Mercury in a Cassini state, with an obliquity ϵ = 2.031 ± 0.03 arcmin compatible with previous “surface” related measurements. Moreover, we provide a first data-based estimate of the Love number h_(2) = 1.55 ± 0.65. The latter is consistent with expectations from models of Mercury's interior, although its precision does not enable their refinement.

S. Bertone↗
DOE OSTI2024

Integrating ytopt and libEnsemble to autotune OpenMC

Ytopt is a Python machine-learning-based autotuning software package developed within the ECP PROTEAS-TUNE project. The ytopt software adopts an asynchronous search framework that consists of sampling a small number of input parameter configurations and progressively fitting a surrogate model over the input-output space until exhausting the user-defined maximum number of evaluations or the wall-clock time. libEnsemble is a Python toolkit for coordinating workflows of asynchronous and dynamic ensembles of calculations across massively parallel resources developed within the ECP PETSc/TAO project. libEnsemble helps users take advantage of massively parallel resources to solve design, decision, and inference problems and expands the class of problems that can benefit from increased parallelism. In this paper we present our methodology and framework to integrate ytopt and libEnsemble to take advantage of massively parallel resources to accelerate the autotuning process. Specifically, we focus on using the proposed framework to autotune the ECP ExaSMR application OpenMC, an open source Monte Carlo particle transport code. OpenMC has seven tunable parameters some of which have large ranges such as the number of particles in-flight, which is in the range of 100,000 to 8 million, with its default setting of 1 million. Setting the proper combination of these parameter values to achieve the best performance is extremely time-consuming. Therefore, we apply the proposed framework to autotune the MPI/OpenMP offload version of OpenMC based on a user-defined metric such as the figure of merit (FoM) (particles/s) or energy efficiency energy-delay product (EDP) on Crusher at Oak Ridge Leadership Computing Facility. In conclusion, the experimental results show that we achieve the improvement up to 29.49% in FoM and up to 30.44% in EDP.

Autotuning↗
NASA NTRS1983

A shock-fitting solution of the supersonic flowfield in a rounded internal corner

A comparison is presented of a computational investigation of the flowfield created by supersonic flow over an internal corner with rounding and experimental results at a freestream Mach number of 4.1. The computational study uses a shock-fitting finite difference scheme with explicit formulation of the transformation to computational coordinates. The solutions calculated agree with previous ones for the sharp corner case and with the experimental investigation results for the rounded corner case. Parametric effects were computed for variations in corner rounding, freestream Mach number, symmetric wedge angle and unsymmetric wedge angle. A region is described over which successful executions were obtained.

Martin, J. A.↗
NASA NTRS1997

Computation of Reacting Flows in Combustion Processes

The main objective of this research was to develop an efficient three-dimensional computer code for chemically reacting flows. The main computer code developed is ALLSPD-3D. The ALLSPD-3D computer program is developed for the calculation of three-dimensional, chemically reacting flows with sprays. The ALL-SPD code employs a coupled, strongly implicit solution procedure for turbulent spray combustion flows. A stochastic droplet model and an efficient method for treatment of the spray source terms in the gas-phase equations are used to calculate the evaporating liquid sprays. The chemistry treatment in the code is general enough that an arbitrary number of reaction and species can be defined by the users. Also, it is written in generalized curvilinear coordinates with both multi-block and flexible internal blockage capabilities to handle complex geometries. In addition, for general industrial combustion applications, the code provides both dilution and transpiration cooling capabilities. The ALLSPD algorithm, which employs the preconditioning and eigenvalue rescaling techniques, is capable of providing efficient solution for flows with a wide range of Mach numbers. Although written for three-dimensional flows in general, the code can be used for two-dimensional and axisymmetric flow computations as well. The code is written in such a way that it can be run in various computer platforms (supercomputers, workstations and parallel processors) and the GUI (Graphical User Interface) should provide a user-friendly tool in setting up and running the code.

Keith, Theo G., Jr.↗
NASA NTRS1975

Accuracy of site coordinates obtainable by a mobile lunar laser station

The accuracy with which a mobile lunar laser station can be located was the subject of a modeling study. The influence of the number and accuracy of fixed lunar ranging stations, the uncertainty in polar motion, and data loss due to weather and similar factors were considered, and the results are given in a cartographic form. In general, all three coordinates (for coordinates to latitude + or - 60 deg) were determined to better than the pole uncertainty, given three or more fixed sites and reasonable weather. This result indicates that one or more mobile stations would be suitable for the study of geotectonics.

Loumos, G. L.↗
DOE OSTI2025

Bond-centric modular design of protein assemblies

Directional interactions that generate regular coordination geometries are a powerful means of guiding molecular and colloidal self-assembly, but implementing such high-level interactions with proteins remains challenging due to their complex shapes and intricate interface properties. Here we describe a modular approach to protein nanomaterial design inspired by the rich chemical diversity that can be generated from the small number of atomic valencies. We design protein building blocks using deep learning-based generative tools, incorporating regular coordination geometries and tailorable bonding interactions that enable the assembly of diverse closed and open architectures guided by simple geometric principles. Experimental characterization confirms the successful formation of more than 20 multicomponent polyhedral protein cages, two-dimensional arrays and three-dimensional protein lattices, with a high (10%–50%) success rate and electron microscopy data closely matching the corresponding design models. Due to modularity, individual building blocks can assemble with different partners to generate distinct regular assemblies, resulting in an economy of parts and enabling the construction of reconfigurable networks for designer nanomaterials.

Biomaterials – proteins↗
DOE OSTI2023

Mechanisms of dissolution from gibbsite step edges elucidated by ab initio molecular dynamics with enhanced sampling

Surface reactions underpin our collective understanding of mineral dissolution. This impacts a range of predictive geochemical models (for weathering, the fate and transport of metals) as well as industrial utilization of minerals. Yet atomistic details are rarely known due to the complex mineral/fluid interfacial environment. There is significant need to understand the mechanistic details of dissolution reactions and how they depend on surface morphology and solution conditions. This work utilizes surface pit models in conjunction with changes to solution composition that mimic pH to explore surface detachment of aluminate from gibbsite, which is a primary source of Al in soils and within the industrial processing of aluminum. Ab initio molecular dynamics simulations with enhanced sampling has been used to explore the detailed process of the detachment, the results of which indicate two potential pathways that are differentiated based upon the extent of water hydration. Here, the heights of the energy barriers depend upon the local morphology which influence the number of bridges (quasi-)simultaneously broken (1 or 2) or the Al-O coordination of the neighboring aluminum atoms (5 or 6) at the armchair edge. pH effects are significant, with a nearly 50% reduction in barrier height under alkaline conditions that are relevant to geothermal fluids and Al extraction from minerals.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2023

Rigorous Oxidation State Assignments for Supported Ga-Containing Catalysts Using Theory-Informed X-ray Absorption Spectroscopy Signatures from Well-Defined Ga(I) and Ga(III) Compounds

Gallium-based heterogeneous catalysts originally developed for commercial use in propane dehydroaromatization have been explored extensively as potential replacements for Pt- and Cr-based catalysts used in propane dehydrogenation for on-demand propylene production. In a large number of experimental and theoretical studies, active sites with a variety of Ga nuclearities, coordination environments, and oxidation states have been proposed. Isolated Ga(I) ions are often invoked, despite the scarcity of well-defined molecular species and their well-documented instability. In this study, we investigate the appearance of a high-intensity, low-energy white line at the Ga K-edge upon reduction of Ga/HZSM-5 by H 2 at a temperature of ca. 500 °C, accompanied by a dramatic reduction in the extended X-ray absorption fine structure (EXAFS) intensity. In contrast, Ga/γ-Al 2 O 3 does not show such behavior. In order to lay a rigorous foundation for characterizing these types of systems and to establish experimental signatures for the elusive Ga(I) oxidation state, we recorded Ga K-edge X-ray absorption spectra [including high-energy-resolution fluorescence detection-X-ray absorption near-edge spectroscopy (HERFD-XANES)] for several well-defined molecular and crystalline Ga(I) compounds. XANES is essential to establishing the presence of Ga(I), despite the overlap in edge energies with organoGa(III) compounds, because Ga(I)-containing oxide materials show very weak EXAFS scattering. Compared to the XANES of trigonal Ga(III)-containing materials, Ga(I) spectra display a significantly more intense white line feature. Theoretical simulations agree well with this experimental observation and reveal that the strong XANES intensity originates from the superposition of transitions to several empty, nearly degenerate p-like states. Finally, these signatures provide compelling evidence for assigning the intense white line and dramatic loss of EXAFS intensity in Ga/HZSM-5 to the near-quantitative reduction of Ga(III) to Ga(I), while the weaker white line and conventional EXAFS signal of Ga/γ-Al 2 O 3 point to, at most, a minor fraction of Ga(I) sites.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Gas Transfer Across Air‐Water Interfaces in Inland Waters: From Micro‐Eddies to Super‐Statistics

In inland water covering lakes, reservoirs, and ponds, the gas exchange of slightly soluble gases such as carbon dioxide, dimethyl sulfide, methane, or oxygen across a clean and nearly flat air‐water interface is routinely described using a water‐side mean gas transfer velocity $\overline{k_{L}}$, where overline indicates time or ensemble averaging. The micro‐eddy surface renewal model predicts $\overline{k_{L}}$ = α o Sc -1/2 ($v\bar{ϵ}$) 1/4 , where Sc is the molecular Schmidt number, $v$ is the water kinematic viscosity, and $\bar{ϵ}$ is the waterside mean turbulent kinetic energy dissipation rate at or near the interface. While α o = 0.39 - 0.46 has been reported across a number of data sets, others report large scatter or variability around this value range. It is shown here that this scatter can be partly explained by high temporal variability in instantaneous ϵ around $\bar{ϵ}$, a mechanism that was not previously considered. As the coefficient of variation (CV e ) in ϵ increases, α o must be adjusted by a multiplier (1 = CV e 2 ) -3/32 that was derived from a log‐normal model for the probability density function of ϵ. Reported variations in α o with a macro‐scale Reynolds number can also be partly attributed to intermittency effects in ϵ. Such intermittency is characterized by the long‐range (i.e., power‐law decay) spatial auto‐correlation function of ϵ. That α o varies with a macro‐scale Reynolds number does not necessarily violate the micro‐eddy model. Instead, it points to a coordination between the macro‐ and micro‐scales arising from the transfer of energy across scales in the energy cascade.

Batchelor scale↗