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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 1,099 records · Page 61

Dynamics of the metastable st12 to diamond-cubic transition in germanium characterized by neutron spectroscopy

Data related to the manuscript "Dynamics of the metastable st12 to diamond-cubic transition in germanium characterized by neutron spectroscopy". It includes density of states results for st12-Ge, dc-Ge, amorphous-Ge, and the relaxation of st12-Ge to dc-Ge. It also includes diffractions results for the same relaxation experiment. The experiment was performed on the ARCS spectrometer at the SNS. See the Readme.md file in the data set for more information.

36 MATERIALS SCIENCE↗

Thermal Properties Measurement Report

The Thermal Properties Measurement Report summarizes the research, development, installation, and initial use of significant experimental thermal property characterization capabilities at the INL in FY 2015. These new capabilities were used to characterize a U 3 Si 2 (candidate Accident Tolerant) fuel sample fabricated at the INL. The ability to perform measurements at various length scales is important and provides additional data that is not currently in the literature. However, the real value of the data will be in accomplishing a phenomenological understanding of the thermal conductivity in fuels and the ties to predictive modeling. Thus, the MARMOT advanced modeling and simulation capability was utilized to illustrate how the microstructural data can be modeled and compared with bulk characterization data. A scientific method was established for thermal property measurement capability on irradiated nuclear fuel samples, which will be installed in the Irradiated Material Characterization Laboratory (IMCL).

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Monte Carlo calculations for reference dosimetry of electron beams with the PTW Roos and NE2571 ion chambers

Purpose: To investigate recommendations for reference dosimetry of electron beams and gradient effects for the NE2571 chamber and to provide beam quality conversion factors using Monte Carlo simulations of the PTW Roos and NE2571 ion chambers. Methods: The EGSnrc code system is used to calculate the absorbed dose-to-water and the dose to the gas in fully modeled ion chambers as a function of depth in water. Electron beams are modeled using realistic accelerator simulations as well as beams modeled as collimated point sources from realistic electron beam spectra or monoenergetic electrons. Beam quality conversion factors are calculated with ratios of the doses to water and to the air in the ion chamber in electron beams and a cobalt-60 reference field. The overall ion chamber correction factor is studied using calculations of water-to-air stopping power ratios. Results: The use of an effective point of measurement shift of 1.55 mm from the front face of the PTW Roos chamber, which places the point of measurement inside the chamber cavity, minimizes the difference betweenR{sub 50}, the beam quality specifier, calculated from chamber simulations compared to that obtained using depth-dose calculations in water. A similar shift minimizes the variation of the overall ion chamber correction factor with depth to the practical range and reduces the root-mean-square deviation of a fit to calculated beam quality conversion factors at the reference depth as a function of R{sub 50}. Similarly, an upstream shift of 0.34 r{sub cav} allows a more accurate determination of R{sub 50} from NE2571 chamber calculations and reduces the variation of the overall ion chamber correction factor with depth. The determination of the gradient correction using a shift of 0.22 r{sub cav} optimizes the root-mean-square deviation of a fit to calculated beam quality conversion factors if all beams investigated are considered. However, if only clinical beams are considered, a good fit to results for beam quality conversion factors is obtained without explicitly correcting for gradient effects. The inadequacy of R{sub 50} to uniquely specify beam quality for the accurate selection of k{sub Q} factors is discussed. Systematic uncertainties in beam quality conversion factors are analyzed for the NE2571 chamber and amount to between 0.4% and 1.2% depending on assumptions used. Conclusions: The calculated beam quality conversion factors for the PTW Roos chamber obtained here are in good agreement with literature data. These results characterize the use of an NE2571 ion chamber for reference dosimetry of electron beams even in low-energy beams.

62 RADIOLOGY AND NUCLEAR MEDICINE↗

Achieving robust somatic mutation detection with deep learning models derived from reference data sets of a cancer sample

Accurate detection of somatic mutations is challenging but critical in understanding cancer formation, progression, and treatment. We recently proposed NeuSomatic, the first deep convolutional neural network-based somatic mutation detection approach, and demonstrated performance advantages on in silico data. In this study, we use the first comprehensive and well-characterized somatic reference data sets from the SEQC2 consortium to investigate best practices for using a deep learning framework in cancer mutation detection. Using the high-confidence somatic mutations established for a cancer cell line by the consortium, we identify the best strategy for building robust models on multiple data sets derived from samples representing real scenarios, for example, a model trained on a combination of real and spike-in mutations had the highest average performance. The strategy identified in our study achieved high robustness across multiple sequencing technologies for fresh and FFPE DNA input, varying tumor/normal purities, and different coverages, with significant superiority over conventional detection approaches in general, as well as in challenging situations such as low coverage, low variant allele frequency, DNA damage, and difficult genomic regions.

59 BASIC BIOLOGICAL SCIENCES↗

Autonomous Metabolomics for Rapid Metabolite Identification in Global Profiling

An autonomous metabolomic workflow combining mass spectrometry analysis with tandem mass spectrometry data acquisition was designed to allow for simultaneous data processing and metabolite characterization. Although previously tandem mass spectrometry data have been generated on the fly, the experiments described herein combine this technology with the bioinformatic resources of XCMS and METLIN. We can analyze large profiling datasets and simultaneously obtain structural identifications, as a result of this unique integration. Furthermore, validation of the workflow on bacterial samples allowed the profiling on the order of a thousand metabolite features with simultaneous tandem mass spectra data acquisition. The tandem mass spectrometry data acquisition enabled automatic search and matching against the METLIN tandem mass spectrometry database, shortening the current workflow from days to hours. Overall, the autonomous approach to untargeted metabolomics provides an efficient means of metabolomic profiling, and will ultimately allow the more rapid integration of comparative analyses, metabolite identification, and data analysis at a systems biology level.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Syntheses, structures, and 1 H, 13 C{ 1 H} and 119 Sn{ 1 H} NMR chemical shifts of a family of trimethyltin alkoxide, amide, halide and cyclopentadienyl compounds

The synthesis and full characterization, including Nuclear Magnetic Resonance (NMR) data ( 1 H, 13 C{ 1 H} and 119 Sn{ 1 H}), for a series of Me 3 SnX (X = O-2,6-tBu 2 C 6 H 3 (1), (Me 3 Sn)N(2,6- i Pr 2 C 6 H 3 ) (3), NH-2,4,6- t Bu 3 C 6 H 2 (4), N(SiMe 3 ) 2 (5), NEt 2 , C 5 Me 5 (6), Cl, Br, I, and SnMe 3 ) compounds in benzene-d 6 , toluene-d 8 , dichloromethane-d 2 , chloroform-d 1 , acetonitrile-d 3 , and tetrahydrofuran-d 8 are reported. The X-ray crystal structures of Me 3 Sn(O-2,6- t Bu 2 C 6 H 3 ) (1), Me 3 Sn(O-2,6- i Pr 2 C 6 H 3 ) (2), and (Me 3 Sn)(NH-2,4,6- t Bu 3 C 6 H 2 ) (4) are also presented. As a result, these compiled data complement existing literature data and ease the characterization of these compounds by routine NMR experiments.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Stack plume characterization and model assessment with lidar data

A mobile lidar system was used to obtain plume rise and dispersion measurements for validating plume models. Predictions of rise and spread from the two-thirds law were found to agree well with observations. These predictions were used in combination with Lamb's results for neutrally buoyant particle diffusion in the mixed layer to estimate dispersion when convective turbulence became important.

Weil, J. C.↗

Laboratory experiments of relevance to the space station environment

It has been found that the interaction between orbital vehicles and the ambient environment produces a contaminant cloud which can cause deletrious effects to spacecraft materials and equipment, create increased radiative backgrounds that would interfere with observational instrumentation, and enhance surface charging. A brief overview of the phenomena that produce the contaminant cloud is presented along with a review of physical data required to characterize it. Laboratory techniques which can be utilized to provide the required data are described. In particular, several oxygen beam apparati are discussed.

Caledonia, G. E.↗

A linear programming approach to characterizing norm bounded uncertainty from experimental data

The linear programming spectral overbounding and factorization (LPSOF) algorithm, an algorithm for finding a minimum phase transfer function of specified order whose magnitude tightly overbounds a specified nonparametric function of frequency, is introduced. This method has direct application to transforming nonparametric uncertainty bounds (available from system identification experiments) into parametric representations required for modern robust control design software (i.e., a minimum-phase transfer function multiplied by a norm-bounded perturbation).

Scheid, R. E.↗

Fiber-matrix interphase characterization in composites using ultrasonic velocity data

A nondestructive method is introduced to determine the effective elastic of fiber-matrix interphases from measured composite moduli. The composite moduli are obtained by measuring the angular dependences of ultrasonic longitudinal and transverse phase velocities in planes along and perpendicular to the fibers. Three independent interphase effective moduli are found using micromechanical multiphase models which were applied after averaging composite transverse moduli to account for the composite orthotropy. Sensitivity analysis shows that errors in the calculated interphasial moduli are approximately ten times those in the composite moduli. Experiments are performed on Si3N4 ceramic and Ti-24Al-11Nb intermetallic matrix composites reinforced with carbon coated silicon carbide fibers. The experimental interphasial moduli for the intermetallic composites agree with literature data after accounting for the interphase microstructure. The interphasial moduli for ceramic composites are lower than those for the intermetallic composite due to imperfect mechanical contact between the interphase and the porous matrix. The use of the method to assess the interphase degradation is demonstrated for interphasial oxidation damage. The analysis helps to determine the morphology of the damaged interphase.

Chu, Y. C.↗

Observational and Data Reduction Techniques to Optimize Mineralogical Characterizations of Asteroid Surface Materials

Mineralogy is the key to determining the compositional history of the asteroids and to determining the genetic relationships between the asteroids and meteorites. The most sophisticated remote mineralogical characterizations involve the quantitative extraction of specific diagnostic parameters from reflectance spectra and the use of quantitative interpretive calibrations to determine the presence, abundance and/or composition of mineral phases in a surface material. Although this approach is potentially subject to systematic errors, it provides the only consistent set of asteroid surface material characterizations.

Gaffey, M. J.↗

Obtaining Accurate Change Detection Results from High-Resolution Satellite Sensors

Multi-date acquisitions of high-resolution imaging satellites (e.g. GeoEye and WorldView), can display local changes of current economic interest. However, their large data volume precludes effective manual analysis, requiring image co-registration followed by image-to-image change detection, preferably with minimal analyst attention. We have recently developed an automatic change detection procedure that minimizes false-positives. The processing steps include: (a) Conversion of both the pre- and post- images to reflectance values (this step is of critical importance when different sensors are involved); reflectance values can be either top-of-atmosphere units or have full aerosol optical depth calibration applied using bi-directional reflectance knowledge. (b) Panchromatic band image-to-image co-registration, using an orthorectified base reference image (e.g. Digital Orthophoto Quadrangle) and a digital elevation model; this step can be improved if a stereo-pair of images have been acquired on one of the image dates. (c) Pan-sharpening of the multispectral data to assure recognition of change objects at the highest resolution. (d) Characterization of multispectral data in the post-image ( i.e. the background) using unsupervised cluster analysis. (e) Band ratio selection in the post-image to separate surface materials of interest from the background. (f) Preparing a pre-to-post change image. (g) Identifying locations where change has occurred involving materials of interest.

multispectral↗

Ontologies for Aviation Data Management

Managing complex aviation data can be a significant challenge for any enterprise – whether a government agency, airline, airframe manufacturer, or aviation service provider. To handle this challenge, data models are typically developed to characterize and manage the data generated, used, and stored by a given enterprise. Unfortunately, different data providers employ qualitatively different data models, and this gives rise to problems exchanging data across organizational boundaries. Over the past decade, these problems have motivated data producers and consumers to look toward standardized data exchange models to address data interoperability. In this paper we examine some of these standardized data exchange models and compare them with a new type of data model based on ontologies. Ontology models have emerged in recent years from a confluence of research in the artificial intelligence, semantic web, and information science communities. This paper introduces ontology models, provides several use cases for ontologies relevant to aviation data management, and summarizes state of the art aviation prototype applications that utilize ontologies.

artificial intelligence↗

Modeling of Guided Waves for Aerospace Applications

Advancements in computer hardware has led to new possibilities for rapid modeling and simulation capabilities across many scientific fields. Nondestructive evaluation (NDE) can benefit from increased use of simulation tools to guide optimization of inspection and health monitoring methods, enhance understanding of data, aid in development of defect characterization methods, and generate data sets for use with machine learning and model-assisted probability of detection. Recent work at NASA has entailed development and benchmarking of both custom simulation codes and commercial simulation tools for ultrasonic wave propagation. This paper describes recent work at NASA in modeling of guided waves in composites and other aerospace materials. Results and computational speeds for a composite benchmark case are reported for a custom finite difference Rotated Staggered Grid code and for the commercial finite element software package, Pogo. Recent progress in linking NDE models to parametric analysis tools is also discussed.

Nondestructive evaluation↗