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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 1,459 records · Page 81
All sourcesNASA NTRSDOE OSTI
NASA NTRSDate not supplied

Fundamental Test of a Hovering Rotor: Comprehensive Measurements for CFD Validation

A model-scale hover test of a 4-bladed, 11.08-ft diameter rotor was recently completed inside the National Full-Scale Aerodynamics Complex 80- by 120-Foot Wind Tunnel test section. The primary objective of the test was to acquire key experimental data for a hovering rotor of sufficient quality and quantity to allow validation of state-of-the-art analysis codes. A comprehensive measurement set has been acquired, including rotor performance, blade airloads, flow transition locations, blade deflections, and wake geometry for a range of tip Mach numbers and collective settings. The present paper provides an overview of the test, including detailed descriptions of the hardware, instrumentation, and measurement systems. In addition, the specific test objectives, approach, and sample results are presented. The full test database, as well as detailed rotor geometry information, will ultimately be shared openly on a NASA-sponsored website to serve as a benchmark validation dataset.

Hover↗
NASA NTRS2007

An Experimental System for a Global Flood Prediction: From Satellite Precipitation Data to a Flood Inundation Map

Floods impact more people globally than any other type of natural disaster. It has been established by experience that the most effective means to reduce the property damage and life loss caused by floods is the development of flood early warning systems. However, advances for such a system have been constrained by the difficulty in estimating rainfall continuously over space (catchment-. national-, continental-. or even global-scale areas) and time (hourly to daily). Particularly, insufficient in situ data, long delay in data transmission and absence of real-time data sharing agreements in many trans-boundary basins hamper the development of a real-time system at the regional to global scale. In many countries around the world, particularly in the tropics where rainfall and flooding co-exist in abundance, satellite-based precipitation estimation may be the best source of rainfall data for those data scarce (ungauged) areas and trans-boundary basins. Satellite remote sensing data acquired and processed in real time can now provide the space-time information on rainfall fluxes needed to monitor severe flood events around the world. This can be achieved by integrating the satellite-derived forcing data with hydrological models, which can be parameterized by a tailored geospatial database. An example that is a key to this progress is NASA's contribution to the Tropical Rainfall Measuring Mission (TRMM), launched in November 1997. Hence, in an effort to evolve toward a more hydrologically-relevant flood alert system, this talk articulates a module-structured framework for quasi-global flood potential naming, that is 'up to date' with the state of the art on satellite rainfall estimation and the improved geospatial datasets. The system is modular in design with the flexibility that permits changes in the model structure and in the choice of components. Four major components included in the system are: 1) multi-satellite precipitation estimation; 2) characterization of land surface including digital elevation from NASA SRTM, topography-derived hydrologic parameters such as flood direction. flow accumulation, basin, and river network etc.; 3) spatially distributed hydrological models to infiltrate rainfall and route overland runoff; and 4) an implementation interface to relay thc input data to the models and display the flood inundation results to the users and decision-makers. Early results appear reasonable in terms of location and frequency of events. Case studies of this experimental system are evaluated with surface runoff data and other river monitoring systems. such as Dartmouth Flood Observatory's "Surface Water Watch" array of river reaches that are measured daily via other satellite remote sensing data. A major outcome of this progress will be the availability of a global overview of flood alerts that should consequently improve the performance of Decision Support System. We expect these developments in utilization of satellite remote sensing technology to offer a practical solution to the challenge of building a cost-effective early warning system for data scarce and under-developed areas.

Adler, Robert↗
DOE OSTI2011

Neutron Cross Section Covariances for Structural Materials and Fission Products

We describe neutron cross section covariances for 78 structural materials and fission products produced for the new US evaluated nuclear reaction library ENDF/B-VII.1. Neutron incident energies cover full range from 10{sup -5} eV to 20 MeV and covariances are primarily provided for capture, elastic and inelastic scattering as well as (n,2n). The list of materials follows priorities defined by the Advanced Fuel Cycle Initiative, the major application being data adjustment for advanced fast reactor systems. Thus, in addition to 28 structural materials and 49 fission products, the list includes also {sup 23}Na which is important fast reactor coolant. Due to extensive amount of materials, we adopted a variety of methodologies depending on the priority of a specific material. In the resolved resonance region we primarily used resonance parameter uncertainties given in Atlas of Neutron Resonances and either applied the kernel approximation to propagate these uncertainties into cross section uncertainties or resorted to simplified estimates based on integral quantities. For several priority materials we adopted MF32 covariances produced by SAMMY at ORNL, modified by us by adding MF33 covariances to account for systematic uncertainties. In the fast neutron region we resorted to three methods. The most sophisticated was EMPIRE-KALMAN method which combines experimental data from EXFOR library with nuclear reaction modeling and least-squares fitting. The two other methods used simplified estimates, either based on the propagation of nuclear reaction model parameter uncertainties or on a dispersion analysis of central cross section values in recent evaluated data files. All covariances were subject to quality assurance procedures adopted recently by CSEWG. In addition, tools were developed to allow inspection of processed covariances and computed integral quantities, and for comparing these values to data from the Atlas and the astrophysics database KADoNiS.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2022

Recent advances and applications of deep learning methods in materials science

Deep learning (DL) is one of the fastest-growing topics in materials data science, with rapidly emerging applications spanning atomistic, image-based, spectral, and textual data modalities. DL allows analysis of unstructured data and automated identification of features. The recent development of large materials databases has fueled the application of DL methods in atomistic prediction in particular. In contrast, advances in image and spectral data have largely leveraged synthetic data enabled by high-quality forward models as well as by generative unsupervised DL methods. In this article, we present a high-level overview of deep learning methods followed by a detailed discussion of recent developments of deep learning in atomistic simulation, materials imaging, spectral analysis, and natural language processing. For each modality we discuss applications involving both theoretical and experimental data, typical modeling approaches with their strengths and limitations, and relevant publicly available software and datasets. We conclude the review with a discussion of recent cross-cutting work related to uncertainty quantification in this field and a brief perspective on limitations, challenges, and potential growth areas for DL methods in materials science.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Accurate small and wide angle x-ray scattering profiles from atomic models of proteins and nucleic acids

A new method is introduced to compute X-ray solution scattering profiles from atomic models of macromolecules. The three-dimensional version of the Reference Interaction Site Model (RISM) from liquid-state statistical mechanics is employed to compute the solvent distribution around the solute, including both water and ions. X-ray scattering profiles are computed from this distribution together with the solute geometry. We describe an efficient procedure for performing this calculation employing a Lebedev grid for the angular averaging. The intensity profiles (which involve no adjustable parameters) match experiment and molecular dynamics simulations up to wide angle for two proteins (lysozyme and myoglobin) in water, as well as the small-angle profiles for a dozen biomolecules taken from the BioIsis.net database. The RISM model is especially well-suited for studies of nucleic acids in salt solution. Use of fiber-diffraction models for the structure of duplex DNA in solution yields close agreement with the observed scattering profiles in both the small and wide angle scattering (SAXS and WAXS) regimes. In addition, computed profiles of anomalous SAXS signals (for Rb{sup +} and Sr{sup 2+}) emphasize the ionic contribution to scattering and are in reasonable agreement with experiment. In cases where an absolute calibration of the experimental data at q = 0 is available, one can extract a count of the excess number of waters and ions; computed values depend on the closure that is assumed in the solution of the Ornstein–Zernike equations, with results from the Kovalenko–Hirata closure being closest to experiment for the cases studied here.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2022

3D Simulations Capture the Persistent Low-Mode Asymmetries Evident in Laser-Direct-Drive Implosions on OMEGA

Spherical implosions in Inertial Confinement Fusion (ICF) are inherently sensitive to perturbations that may arise from experimental constraints and errors. Control and mitigation of low-mode (long wavelengths) perturbations is a key milestone to improving implosion performances. Here, we present the first 3-D radiation-hydrodynamic simulations of directly driven ICF implosions with an inline package for polarized Crossed-Beam Energy Transfer (CBET). Simulations match bang times, yields (separately accounting for laser-induced high modes and fuel age), hot spot flow velocities and direction, for which polarized CBET contributes to the systematic flow orientation evident in the OMEGA implosion database. Current levels of beam mispointing, imbalance, target offset and asymmetry from polarized CBET degrade yields by more than 40%. The effectiveness of two mitigation strategies for low-modes is explored.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2014

EBR-II Data Digitization

1. Objectives To produce a validation database out of those recorded signals it will be necessary also to identify the documents need to reconstruct the status of reactor at the time of the beginning of the recordings. This should comprehends the core loading specification (assemblies type and location and burn-up) along with this data the assemblies drawings and the core drawings will be identified. The first task of the project will be identify the location of the sensors, with respect the reactor plant layout, and the physical quantities recorded by the Experimental Breeder Reactor-II (EBR-II) data acquisition system. This first task will allow guiding and prioritizing the selection of drawings needed to numerically reproduce those signals. 1.1 Scopes and Deliverables The deliverables of this project are the list of sensors in EBR-II system, the identification of storing location of those sensors, identification of a core isotopic composition at the moment of the start of system recording. Information of the sensors in EBR-II reactor system was summarized from the EBR-II system design descriptions listed in Section 1.2.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
NASA NTRS2002

Unsteady Pressures in a Transonic Fan Cascade Due to a Single Oscillating Airfoil

An extensive set of unsteady pressure data was acquired along the midspan of a modern transonic fan blade for simulated flutter conditions. The data set was acquired in a nine-blade linear cascade with an oscillating middle blade to provide a database for the influence coefficient method to calculate instantaneous blade loadings. The cascade was set for an incidence of 10 dg. The data were acquired on three stationary blades on each side of the middle blade that was oscillated at an amplitude of 0.6 dg. The matrix of test conditions covered inlet Mach numbers of 0.5, 0.8, and 1.1 and the oscillation frequencies of 200, 300, 400, and 500 Hz. A simple quasiunsteady two-dimensional computer simulation was developed to aid in the running of the experimental program. For high Mach number subsonic inlet flows the blade pressures exhibit very strong, low-frequency, self-induced oscillations even without forced blade oscillations, while for low subsonic and supersonic inlet Mach numbers the blade pressure unsteadiness is quite low. The amplitude of forced pressure fluctuations on neighboring stationary blades strongly depends on the inlet Mach number and forcing frequency. The flowfield behavior is believed to be governed by strong nonlinear effects due to a combination of viscosity, compressibility, and unsteadiness. Therefore, the validity of the quasi-unsteady simplified computer simulation is limited to conditions when the flowfield is behaving in a linear, steady manner. Finally, an extensive set of unsteady pressure data was acquired to help development and verification of computer codes for blade flutter effects.

Lepicovsky, J.↗
DOE OSTI2021

Benchmarking Coordination Number Prediction Algorithms on Inorganic Crystal Structures

Coordination numbers and geometries form a theoretical framework for understanding and predicting materials properties. Algorithms to determine coordination numbers automatically are increasingly used for machine learning and automatic structural analysis. In this work, we introduce MaterialsCoord, a benchmark suite containing 56 experimentally-derived crystal structures (spanning elements, binaries, and ternary compounds) and their corresponding coordination environments as described in the research literature. We also describe CrystalNN, a novel algorithm for determining near neighbors. We compare CrystalNN against 7 existing near-neighbor algorithms on the MaterialsCoord benchmark, finding CrystalNN to perform similarly to several well-established algorithms. For each algorithm, we also assess computational demand and sensitivity towards small perturbations that mimic thermal motion. Finally, we investigate the similarity between bonding algorithms when applied to the Materials Project database. Finally, we expect that this work will aid the development of coordination prediction algorithms as well as improve structural descriptors for machine learning and other applications.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2014

Characterization of starting minerals to be used in kinetic experiments

Lawrence Livermore National Laboratory is expanding the geochemical for kinetic database for minerals identified in EGS shear stimulation zones to 300°C. In this report we present characterization data for select fracture filling minerals prior to reaction at elevated temperature. We have measured the surface area, chemical composition and crystal structure for illite, phologopite, and biotite. We are currently purchasing smectite from a different source because our initial source proved to be of poor quality. The minerals were ground and mechanically sieved and separated into the desired size fraction (150-250 µm). In keeping with previously published geochemical experimental work on similar layered silicates (e.g., Sass et al., 1987; Kohler et al., 2003), this size fraction was further treated with an acid wash to remove potential carbonate impurities (Zavarin et al., 2012). The mineral separates were then dried and re-sieved, and stored for further characterization analysis and kinetic experimentation.

15 GEOTHERMAL ENERGY↗
DOE OSTI2016

Crystal Structures, Surface Stability, and Water Adsorption Energies of La-Bastnäsite via Density Functional Theory and Experimental Studies

Bastnasite is a fluoro-carbonate mineral that is the largest source of rare earth elements such as Y, La, and Ce. With increasing demand for REE in many emerging technologies, there is an urgent need for improving the efficiency of ore beneficiation by froth flotation. In order to design improved flotation agents that can selectively bind to the mineral surface, a fundamental understanding of the bulk and surface properties of bastnäsite is essential. Density functional theory calculations using the PBEsol exchange correlation functional and the DFT-D3 dispersion correction reveal that the most stable form of La-bastnäsite is isomorphic to the structure of Ce-bastnäsite belonging to the $P\bar{62}c$ space group, while the Inorganic Crystal Structure Database structure in the $P\bar{62}m$ space group is ca. 11.3 kJ/mol higher in energy per LaFCO 3 formula unit. We report powder X-ray diffraction measurements on synthetic of La-bastnäsite to support these theoretical findings. Six different surfaces are studied by DFT, namely [$10\bar{10}$], [0001], [$10\bar{11}$], [$10\bar{12}$], [$10\bar{14}$] and [$11\bar{22}$]. Among these, the [$10\bar{10}$] surface is the most stable with a surface energy of 0.73 J/m 2 in vacuum and 0.45 J/m 2 in aqueous solution. We predicted the shape of a La-bastnäsite nanoparticle via thermodynamic Wulff construction to be a hexagonal prism with [$10\bar{10}$] and [0001] facets, chiseled at its ends by the [$10\bar{11}$] and [$10\bar{12}$] facets. The average surface energy of the nanoparticle in the gas phase is estimated to be 0.86 J/m 2 , in good agreement with a value of 1.11 J/m 2 measured by calorimetry. The calculated adsorption energy of a water molecule varies widely with the surface plane and specific adsorption sites on a given surface. Moreover, the first layer of water molecules is predicted to adsorb strongly on the La-bastnäsite surface, in agreement with water adsorption calorimetry experiments. Our work provides an important step towards a detailed atomistic understanding of the bastnäsite water interface and designing collector molecules that can bind specifically to bastnäsite.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Computational and experimental search for potential polyanionic K-ion cathode materials

Discovering high-energy cathode materials is critical to construct K-ion batteries for practical applications. Owing to the great success of layered oxides in Li- and Na-ion systems, K layered cathodes have also been investigated in recent years. However, the much larger size of K + compared to Li or Na introduces strong K + –K + interaction within the layer, which results in a sloped voltage profile thereby limiting the specific capacity and operating voltage. In contrast, polyanionic materials with a three-dimensional K + arrangement can effectively mitigate K + –K + interaction. In this work, ten K polyanionic compounds with theoretical capacity >100 mA h g –1 are screened from the Inorganic Crystal Structure Database as potential cathode materials for K-ion batteries. Among the ten proposed compounds, K 2 MnP 2 O 7 , K 2 Mn 2 P 2 O 7 F 2 , K 2 Fe 2 P 2 O 7 F 2 , and K 6 V 2 (PO 4 ) 4 with average voltage <4.5 V are synthesized and evaluated electrochemically. While the re-insertion of K into these compounds is not fully reversible, it may be related to the very high migration barrier that we compute for K ions. In addition, we show the successful synthesis of a series of K 3 V 3–x Cr x (PO 4 ) 4 (x = 0, 1, 2, 3) compounds. Among these, K 3 V 2 Cr(PO 4 ) 4 exhibits the largest reversible capacity, as revealed by the in situ investigation. Lastly, we find that the redox couples in many of these compounds sit at remarkably high potential, even higher than in equivalent Li compounds, which brings both opportunities and challenges in the future research of K polyanion cathodes.

25 ENERGY STORAGE↗
DOE OSTI2026

An Infrared Database of n/k Optical Constants for Calculating Aerosol Spectra for the PICARD Program

The objective of the PICARD Program is to develop fieldable sensing platforms for the rapid chemical identification of aerosol particles in plumes. Standoff detection involves interrogating the aerosol cloud from a distance using optical methods and probing the signal returned from direct backscattering from the aerosol particles or transmitted through the plume after reflection from a retroreflector or surface of opportunity (SOO). The identification of chemical species, however, in aerosols is complicated by their complex compositions and morphologies, chemical interferants, and non-uniform particle sizes. To advance standoff detection of aerosols, modelling the infrared transmittance, reflectance and scattering spectra of aerosolized liquid and solid chemical compounds is required, and then testing that model experimentally via laboratory and field experiments. To perform accurate modeling, the infrared optical constants (n/k), i.e., the complex refractive index, of the compounds of interest are required. Thus, PNNL was tasked to provide the optical constants for a set of analytes relevant to the PICARD program. This report describes the experimental techniques used to derive the optical constants of both liquid and solid compounds using established “gold-standard” protocols, how the experimental data are processed to produce the wavenumber dependent optical constant vectors, and how the data are used in the aerosol absorption spectra modeling.

complex refractive index↗
DOE OSTI2023

Optimizing the HSX stellarator for microinstability by coil-current adjustments

Abstract The optimization of helically symmetric experiment (HSX) for reduced microinstability has been achieved by examining a large set of configurations within a neighborhood of the standard operating configuration. This entailed generating a database of more than 10 6 magnetic-field configurations for HSX by varying the currents in external coils. Using a set of volume-averaged metrics and gyrokinetic simulations, this database has helped to identify a set of configurations that can be used to regulate trapped-electron-mode stability in HSX. This set of configurations is also found to correlate flux-surface elongation and triangularity with an increase in magnetic-well depth, an increase in rotational transform, and low neoclassical heat-flux relative to the standard quasi-helically-symmetric configuration. These results demonstrate sensitivity of plasma behavior in response to changes in a 3D magnetic field to both neoclassical and gyrokinetic models, and the experimental potential in HSX to explore turbulence optimization. This perturbative optimization approach is not unique to HSX, and can readily be deployed on existing fusion devices to identify novel magnetic-fields to be used in turbulence-optimization experiments.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS1998

Aerospace Medicine and Biology: A Continuing Bibliography

This supplemental issue of Aerospace Medicine and Biology, A Continuing Bibliography with Indexes lists reports, articles, and other documents recently announced in the NASA STI Database. In its subject coverage, Aerospace Medicine and Biology concentrates on the biological, physiological, psychological, and environmental effects to which humans are subjected during and following simulated or actual flight in the Earth's atmosphere or in interplanetary space. References describing similar effects on biological organisms of lower order are also included. Such related topics as sanitary problems, pharmacology, toxicology, safety and survival, life support systems, exobiology, and personnel factors receive appropriate attention. Applied research receives the most emphasis, but references to fundamental studies and theoretical principles related to experimental development also qualify for inclusion.

Source record↗
NASA NTRS1998

Aerospace Medicine and Biology: A Continuing Bibliography

This supplemental issue of Aerospace Medicine and Biology, A Continuing Bibliography with Indexes (NASA/SP-1998-7011) lists reports, articles, and other documents recently announced in the NASA STI Database. In its subject coverage, Aerospace Medicine and Biology concentrates on the biological, physiological, psychological, and environmental effects to which humans are subjected during and following simulated or actual flight in the Earth's atmosphere or in interplanetary space. References describing similar effects on biological organisms of lower order are also included. Such related topics as sanitary problems, pharmacology, toxicology, safety and survival, life support systems, exobiology, and personnel factors receive appropriate attention. Applied research receives the most emphasis, but references to fundamental studies and theoretical principles related to experimental development also qualify for inclusion. Each entry in the publication consists of a standard bibliographic citation accompanied, in most cases, by an abstract.

Source record↗
NASA NTRS1998

Aerospace Medicine and Biology: A Continuing Bibliography with Indexes

This supplemental issue of Aerospace Medicine and Biology, A Continuing Bibliography with Indexes (NASA/SP-1998-7011) lists reports, articles, and other documents recently announced in the NASA STI Database. In its subject coverage, Aerospace Medicine and Biology concentrates on the biological, physiological, psychological, and environmental effects to which humans are subjected during and following simulated or actual flight in the Earth's atmosphere or in interplanetary space. References describing similar effects on biological organisms of lower order are also included. Such related topics as sanitary problems, pharmacology, toxicology, safety and survival, life support systems, exobiology, and personnel factors receive appropriate attention. Applied research receives the most emphasis, but references to fundamental studies and theoretical principles related to experimental development also qualify for inclusion. Each entry in the publication consists of a standard bibliographic citation accompanied, in most cases, by an abstract.

Source record↗
NASA NTRS1998

Aerospace Medicine and Biology: A Continuing Bibliography with Indexes

This supplemental issue of Aerospace Medicine and Biology, A Continuing Bibliography with Indexes (NASA/SP-1998-7011) lists reports, articles, and other documents recently announced in the NASA STI Database. In its subject coverage, Aerospace Medicine and Biology concentrates on the biological, physiological, psychological, and environmental effects to which humans are subjected during and following simulated or actual flight in the Earth's atmosphere or in interplanetary space. References describing similar effects on biological organisms of lower order are also included. Such related topics as sanitary problems, pharmacology, toxicology, safety and survival, life support systems, exobiology, and personnel factors receive appropriate attention. Applied research receives the most emphasis, but references to fundamental studies and theoretical principles related to experimental development also qualify for inclusion. Each entry in the publication consists of a standard bibliographic citation accompanied, in most cases, by an abstract.

Source record↗