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At least 1,189 records · Page 66

Using Receiver Operating Characteristic Curves to Optimize Discovery-Based Software with Comprehensive Two-Dimensional Gas Chromatography with Time-of-Flight Mass Spectrometry

We report a quantitative approach to optimize implementation of discovery-based software for comprehensive two-dimensional gas chromatography coupled with time-of-flight mass spectrometry (GC × GC – TOFMS). The software performs a tile-based Fisher ratio (F-ratio) analysis, and facilitates a supervised non-targeted analysis based upon the experimental design to aid in the discovery of analytes whose variances are statistically different between sample classes. The quantitative approach for software optimization uses receiver operating characteristic (ROC) curves. The area under the curve (AUC) of each ROC curve serves as a quantitative metric to optimize two key algorithm parameters: the signal-to-noise ratio (S/N) threshold of the baseline corrected and normalized data prior to calculating F-ratios at each m/z mass channel, and the number of these F-ratios per m/z to include in the calculation of the average F-ratio of a tile. A total of 25 combinations of S/N threshold by number of m/z were studied. Fifty analytes were spiked into a diesel fuel at two concentration spike levels to produce two sample classes that should in principle produce 50 positive instances in the ROC curves (30 native/20 non-native compounds, at spike levels of 200/20 and100/10 ppm native/non-native, respectively). The “sweet spot” for F-ratio analysis was determined to be a S/N threshold of 10 coupled with a maximum of the 10 most chemically selective m/z (requiring a minimum of 3 m/z), corresponding to a ~ 21% improvement in the discovery rate of true positives relative to prior studies. Furthermore, it was observed that optimization of these software parameters did not depend upon a priori determination of the statistically correct number of positive instances in the sample classes. The AUC metric appears to be suitable for the evaluation of all data analysis methods that utilize the proper experimental design.

3D-GS/TOFMS, Data discovery, ROC curves, Fisher ra↗

Enhancement of Earth Resources Technology Satellite /ERTS/ and aircraft imagery using atmospheric corrections.

The studies considered are concerned with the magnitude of the atmospheric effects in multispectral earth resources data taken by satellites and aircraft. The atmospheric effects are present in all space oriented and aerial data even in the so-called atmospheric 'windows' through which all sensors observe the ground. Atmospheric effects are quite varied and depend on several parameters. An atmospheric model developed by Turner et al. (1971) is discussed. The model is applied to the test site, which is located in North Dakota. The results are used to obtain atmospheric correction data for ERTS-1 scanner data.

Sharma, R. D.↗

The Influence of Residual Stress on Fatigue Crack Growth Rates in Stainless Steel Processed by Different Additive Manufacturing Methods

The properties and microstructure of Type 304L stainless steel produced by two additive manufacturing (AM) methods—directed energy deposition (DED) and powder bed fusion (PBF)—are evaluated and compared. Localized heating and steep temperature gradients of AM processes lead to significant residual stress and distinctive microstructures, which may be process-specific and influence mechanical behavior. Test data show that materials produced by DED and PDF have small differences in tensile strengths but clear differences in residual stress and microstructural features. Measured fatigue crack growth rates (FCGRs) for cracks propagating parallel to and perpendicular to the build directions differ between the two AM materials. To separate the influences of residual stress and microstructure, K-control test procedures with decreasing and constant stress intensity factor ranges are used to measure FCGRs in the near-threshold regime (crack growth rates ≤ 1 × 10 −8 m/cycle). Residual stress is quantified by the residual stress intensity factor, K res , measured by the online crack compliance method. Correcting the FCGR data for differences in K res brings results for specimens of the two AM materials into agreement with each other and with results for wrought specimens, when the latter are corrected for crack closure. Differences in microstructure and tensile strength have an insignificant influence on FCGRs in these tests.

additive manufacturing↗

Low-Speed Pressure Sensitive Paint Studies

A series of low speed (M less than 0.2) experiments using University of Washington Fib-07 Pressure Sensitive Paint (PSP) have been conducted at NASA Ames on a NACA 0012 airfoil. Significant improvements in results have been shown: PSP calibration errors of the improved data (with pressure taps as a reference) now agree with theoretical error limits. Additional measurements on the 0012 airfoil using Temperature Sensitive Paint have been made. These TSP measurements now fully quantify the impact of temporal temperature changes on model surfaces on PSP measurements. Finally, simultaneous PSP - TSP measurements have been performed, allowing in-situ temperature correction of PSP data with good results.

Owen, Brown↗

Study on spectral/radiometric characteristics of the Thematic Mapper for land use applications

Previous characterization of scan-related low-frequency noise was extended and refined through detailed analysis of shutter calibration data on CCT-ADDS tapes and reflective-band data from nighttime acquisitions. A recommended correction procedure was identified that uses calibration shutter data both as a diagnostic and to obtain correction values. Through comparison of coincident TM and MSS data, illustrations of the added information content of TM data for agricultural applications were developed. The capability of improved spatial resolution to better define boundaries and to resolve spatial details is shown. Spectral analysis of tasseled-cap transformations of TM and MSS data shows high correlation between greenness features, greater signal range for TM, and indications that a subset of TM bands could accurately simulate MSS data, if required.

Malila, W. A.↗

Pantropical Tree Sapwood Hydraulic Properties, 1991 - 2014

This data package contains sapwood pressure-volume parameters including osmotic potential at full turgot, turgor loss point, bulk elastic modulus, and others, determined by curve fitting to raw isotherm data (paired measurements of water content and water potential). Raw data were digitized from published figures. Data are from natural tropical and subtropical forests or savannas and span rainfall gradients from deciduous dry tropical forests to everwet tropical forests, and come from the following countries: Argentina, Panama, Brazil, Costa Rica, and Madagascar. Included in the attached zip file are four CSV files. sapwood_PV_recal_headers.csv: description of variables in the two files below sapwood_PV_recal_corrected.csv: bias-corrected sapwood PV data (see Methods in the associated reference) sapwood_PV_recal_uncorrected.csv: uncorrected sapwood PV data (see Methods in the associated reference) sapwood_PV_references.csv: citation, bibliographic reference, and DOI for the published references from which data were extracted.

54 ENVIRONMENTAL SCIENCES↗

Meta-Analysis of Advanced Nuclear Reactor Cost Estimations

Supporting Data can be downloaded at: https://gain.inl.gov/content/uploads/4/2024/06/INL-RPT-24-77048-R1.xlsx Nuclear energy is a critical cornerstone of the current United States clean energy supply and may play a larger role in the future in support of a transition to a net-zero economy. The current fleet of nuclear reactors predominantly consists of large light-water reactors (LWRs), while many of the reactor designs under consideration are smaller and/or different technologies. Because these new designs have not yet been built, there is a high degree of uncertainty associated with their cost. This complicates energy-planning efforts because cost projections are not always standardized, consistent, and centralized in an easily accessible location. To help support energy planning in the US, this report provides advanced nuclear cost ranges using a transparent methodology along with other relevant information that can be used to help support decision making and energy planning. The purpose of this work was to conduct a methodical process for cost evaluation using only public information that was vetted with the end-goal to provide reference cost projections for nuclear energy. To provide a solid basis for these values, the approach and assumptions are explicitly laid out throughout the report allowing any user of the data to challenge or reconsider them. Because future US nuclear-reactor costs are still unknown due to little recent observed data, the report opted to compile a comprehensive list of bottom-up estimates and evaluate averages/trends within the data to identify reference ranges. This was deemed preferable to opining on the robustness or validity of one cost estimation versus another. To that end, the work evaluated thousands of lines of cost subaccounts from several bottom-up cost estimates. A wide variety of different reactor types captured in the data are of various sizes and technologies. Some of these reactors will be representative of advanced reactors under development while others will not. Thus, the results here are dependent on the data that are available and the accuracy of the estimates that are used. Each bottom-up estimate was reviewed to determine whether it was complete. Incomplete data sets were corrected to ensure an adequate basis of cross-comparison. The report is not without limitations and should be interpreted as an initial step to develop cost ranges for nuclear technology. Ultimately, future work can build upon the methodology with refined cost estimates to reduce uncertainty. US-based overnight capital cost (OCC) estimates were compiled from extensive data sets into ranges for both large and small reactor sizes for 2030. To project the cost declines over time, learning rates were sampled from literature sources. No SMRs were previously built; hence, learning rates based on bottom-up approaches (e.g., by quantifying the impact stemming from fabrication of different components, modular work, site construction, commissioning) were prioritized. For larger reactors, actual learning rates from deployments were used to project future costs (adjusted to account for standardization or lack thereof between designs). Other costs included are fixed and variable operations and maintenance costs. The final variables were capacity factors and ramp rates to support energy planning.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

MAC Europe 1991: Evaluation of AVIRIS, GER imaging spectrometry data for the land application testsite Oberpfaffenhofen

During the MAC Europe 91 Campaign, the area of Oberpfaffenhofen including the land application testsite Oberpfaffenhofen was flown by the AVIRIS imaging spectrometer, the GER 2 imaging spectrometer (63 band scanner), and two SAR systems (NASA/JPL AIRSAR and DLR E-SAR). In parallel to the overflights ground spectrometry (ASD, IRIS M IV) and atmospheric measurements were carried out in order to provide data for optical sensor calibration. Ground spectrometry measurements were carried out in the runway area of the DLR research center Oberpfaffenhofen. This area was used as well during the GER 2 European flight campaign EISAC 89 as a calibration target. The land application testsite Oberpfaffenhofen is located 3 km north of the DLR research center. During the MAC Europe 91 Campaign a ground survey was carried out for documentation in the ground information data base (vegetation type, vegetation geometry, soil type, and soil mixture). Crop stands analyzed were corn, barley and rape. The DLR runway area and the land application testsite Oberpfaffenhofen were flown with the AVIRIS on 29 July and with the GER 2 on 12 and 23 July and 3 Sep. AVIRIS and GER 2 scenes were processed and atmospherically corrected for optical data analysis of optical and radar data. For the AVIRIS and the GER 2 scenes, signal-to-noise ratios (SNR) estimates were calculated. An example of the reflectance of 6 calibration targets inside a GER 2 scene of Oberpfaffenhofen is given. SNR values for the GER 2 for a medium albedo target are given. The integrated analysis for the optical and radar data was carried out in cooperation with the DLR Institute for Microwave Technologies.

Lehmann, F.↗

Small-wedge synchrotron and serial XFEL datasets for Cysteinyl leukotriene GPCRs

Structural studies of challenging targets such as G protein-coupled receptors (GPCRs) have accelerated during the last several years due to the development of new approaches, including small-wedge and serial crystallography. Here, we describe the deposition of seven datasets consisting of X-ray diffraction images acquired from lipidic cubic phase (LCP) grown microcrystals of two human GPCRs, Cysteinyl leukotriene receptors 1 and 2 (CysLT 1 R and CysLT 2 R), in complex with various antagonists. Five datasets were collected using small-wedge synchrotron crystallography (SWSX) at the European Synchrotron Radiation Facility with multiple crystals under cryo-conditions. Two datasets were collected using X-ray free electron laser (XFEL) serial femtosecond crystallography (SFX) at the Linac Coherent Light Source, with microcrystals delivered at room temperature into the beam within LCP matrix by a viscous media microextrusion injector. All seven datasets have been deposited in the open-access databases Zenodo and CXIDB. Here, we describe sample preparation and annotate crystallization conditions for each partial and full datasets. We also document full processing pipelines and provide wrapper scripts for SWSX and SFX data processing. A Correction to this paper has been published: https://doi.org/10.1038/s41597-020-00759-w

97 MATHEMATICS AND COMPUTING↗

General Interaction Data Interface

The General Interaction Data Interface (GIDI) is a C++ API that reads and writes nuclear reaction data stored in the General Nuclear Data Structure (GNDS). GNDS is a new "format" for storing nuclear reaction data developed by the Working Party on Evaluation Co-operation (OECD/NEA/WPEC) Subgroup 38. GNDS can store evaluated nuclear data as well as nuclear data processed for deterministic (multi-group) and Monte Carlo transport. GIDI handles and provides accesses to all forms of the GNDS nuclear data. For multi-group data, GIDI provides functions to sum the data over all reactions. It also has functions for collapsing multi-group data to a small subset of groups and can transport correct multi-group data using the Pendlebury/Underhill formalism. The GNDS definition supports data for a PROjectile hitting a TARget for a given Evaluation. In GIDI this is called a PROTARE. For example, a neutron hitting O-16 from the ENDF/B-VIII.0 evaluation. To support a collection of protares, GIDI adds a Map class. The map class reads in a "map" file which specifies a list of projectile/target/evalaution's and their associated protare files. With a map instance, a user can request a specific projectile/target/evaluation and the map instance will return the requested protare.

Beck, Bret↗

Aero-Assisted Orbital Transfer Vehicle (AOTV)

The AOTV will make use of the atmosphere to provide braking on return from a planetary mission or geosynchronous orbit. The minimum altitude for aerobraking is typically 255,000 ft at the equator. Time of the braking maneuver is typically 480 sec from 400,000 ft to 255,000 ft and back out - about 8 min. The problem is to design a control system that will be able to handle density irregularities such as those that have shown up in shuttle data near 280,000 ft. To obtain data, one has to use model-produced statistics or information obtained during the atmospheric transit time. The Global Reference Atmosphere Model (GRAM) appears to bracket the shuttle data, but it is not clear that the statistics are correct. The model-data exhibits strong density shears over small step size that are probably an artifact.

Hill, Oliver↗

Hyperspectral data analysis for estimation of foliar biochemical content along the Oregon transect

The NASA Oregon Transect Ecosystem Research (OTTER) project completed a data acquisition phase. Data were acquired with several airborne imaging spectrometers. Included were the Airborne Visible and Infrared Imaging Spectrometer (AVIRIS) aboard the ER-2, the Advanced Solidstate Array Spectrometer (ASAS) aboard the C-130, and the Fluorescence Line Imager (FLI) and Compact Airborne Spectrographic Imager (CASI), both aboard light aircraft. In addition, Spectron visible and near-infrared data were acquired in transects across study areas from a low-altitude ultralight craft. Sunphotometer data were taken approximately coincident with each overflight for atmospheric correction of the aircraft data.

Johnson, Lee F.↗

Signal processing for airborne doppler radar detection of hazardous wind shear as applied to NASA 1991 radar flight experiment data

Radar data collected during the 1991 NASA flight tests have been selectively analyzed to support research directed at developing both improved as well as new algorithms for detecting hazardous low-altitude windshear. Analysis of aircraft attitude data from several flights indicated that platform stability bandwidths were small compared to the data rate bandwidths which should support an assumption that radar returns can be treated as short time stationary. Various approaches at detection of weather returns in the presence of ground clutter are being investigated. Non-coventional clutter rejection through spectrum mode tracking and classification algorithms is a subject of continuing research. Based upon autoregressive modeling of the radar return time sequence, this approach may offer an alternative to overcome errors in conventional pulse-pair estimates. Adaptive filtering is being evaluated as a means of rejecting clutter with emphasis on low signal-to-clutter ratio situations, particularly in the presence of discrete clutter interference. An analysis of out-of-range clutter returns is included to illustrate effects of ground clutter interference due to range aliasing for aircraft on final approach. Data are presented to indicate how aircraft groundspeed might be corrected from the radar data as well as point to an observed problem of groundspeed estimate bias variation with radar antenna scan angle. A description of how recorded clutter return data are mixed with simulated weather returns is included. This enables the researcher to run controlled experiments to test signal processing algorithms. In the summary research efforts involving improved modelling of radar ground clutter returns and a Bayesian approach at hazard factor estimation are mentioned.

Baxa, Ernest G., Jr.↗

Intelligent data presentation for real-time spacecraft monitoring

This paper describes an intelligent user interface that is currently under development. The interface serves as a front end for real-time spacecraft monitoring software. The software operates under circumstances in which neither an intelligent human without automated assistance nor an automated system without intelligence are sufficiently effective. The user interface is supported by dynamic trade-off evaluation (DTE), a new technique that has been developed to automate general types of performance trade-offs in real-time problem solving systems. In this application, DTE is used to perform dynamic input data management for the purpose of determining which input data should be monitored in time constrained situations and how to present the monitoring information to a human analyst who has the ultimate responsibility for the spacecraft. This application has demonstrated that DTE can be used to dynamically vary the data that is monitored, making it possible to detect and correctly analyze all anomalous data by examining only a subset of the total input data. In carefully structured experimental evaluations that use real spacecraft data and real decision making, DTE provides the ability to handle a three-fold increase in input data (in real-time) without loss of performance and to intelligently present the information to a mission analyst.

Schwuttke, U. M.↗

Potassium Isotopic Compositions of NIST Potassium Standards and 40Ar/39Ar Mineral Standards

Knowledge of the isotopic ratios of standards, spikes, and reference materials is fundamental to the accuracy of many geochronological methods. For example, the 238U/235U ratio relevant to U-Pb geochronology was recently re-determined [1] and shown to differ significantly from the previously accepted value employed during age determinations. These underlying values are fundamental to accurate age calculations in many isotopic systems, and uncertainty in these values can represent a significant (and often unrecognized) portion of the uncertainty budget for determined ages. The potassium isotopic composition of mineral standards, or neutron flux monitors, is a critical, but often overlooked component in the calculation of K-Ar and 40Ar/39Ar ages. It is currently assumed that all terrestrial materials have abundances indistinguishable from that of NIST SRM 985 [2]; this is apparently a reasonable assumption at the 0.25per mille level (1σ) [3]. The 40Ar/39Ar method further relies on the assumption that standards and samples (including primary and secondary standards) have indistinguishable 40K/39K values. We will present data establishing the potassium isotopic compositions of NIST isotopic K SRM 985, elemental K SRM 999b, and 40Ar/39Ar biotite mineral standard GA1550 (sample MD-2). Stable isotopic compositions (41K/39K) were measured by the peak shoulder method with high resolution MC-ICP-MS (Thermo Scientific NEPTUNE Plus), using the accepted value of NIST isotopic SRM 985 [2] for fractionation [4] corrections [5]. 40K abundances were measured by TIMS (Thermo Scientific TRITON), using 41K/39K values from ICP-MS measurements (or, for SRM 985, values from [2]) for internal fractionation corrections. Collectively these data represent an important step towards a metrologically traceable calibration of 40K concentrations in primary 40Ar/39Ar mineral standards and improve uncertainties by ca. an order of magnitude in the potassium isotopic compositions of standards.

Morgan, Leah↗

WE-AB-207A-08: BEST IN PHYSICS (IMAGING): Advanced Scatter Correction and Iterative Reconstruction for Improved Cone-Beam CT Imaging On the TrueBeam Radiotherapy Machine

Purpose: To improve CBCT image quality for image-guided radiotherapy by applying advanced reconstruction algorithms to overcome scatter, noise, and artifact limitations Methods: CBCT is used extensively for patient setup in radiotherapy. However, image quality generally falls short of diagnostic CT, limiting soft-tissue based positioning and potential applications such as adaptive radiotherapy. The conventional TrueBeam CBCT reconstructor uses a basic scatter correction and FDK reconstruction, resulting in residual scatter artifacts, suboptimal image noise characteristics, and other artifacts like cone-beam artifacts. We have developed an advanced scatter correction that uses a finite-element solver (AcurosCTS) to model the behavior of photons as they pass (and scatter) through the object. Furthermore, iterative reconstruction is applied to the scatter-corrected projections, enforcing data consistency with statistical weighting and applying an edge-preserving image regularizer to reduce image noise. The combined algorithms have been implemented on a GPU. CBCT projections from clinically operating TrueBeam systems have been used to compare image quality between the conventional and improved reconstruction methods. Planning CT images of the same patients have also been compared. Results: The advanced scatter correction removes shading and inhomogeneity artifacts, reducing the scatter artifact from 99.5 HU to 13.7 HU in a typical pelvis case. Iterative reconstruction provides further benefit by reducing image noise and eliminating streak artifacts, thereby improving soft-tissue visualization. In a clinical head and pelvis CBCT, the noise was reduced by 43% and 48%, respectively, with no change in spatial resolution (assessed visually). Additional benefits include reduction of cone-beam artifacts and reduction of metal artifacts due to intrinsic downweighting of corrupted rays. Conclusion: The combination of an advanced scatter correction with iterative reconstruction substantially improves CBCT image quality. It is anticipated that clinically acceptable reconstruction times will result from a multi-GPU implementation (the algorithms are under active development and not yet commercially available). All authors are employees of and (may) own stock of Varian Medical Systems.

60 APPLIED LIFE SCIENCES↗

Coronal Thermal Structure and Abundance of Super-Metal-Rich Late-Type Stars

This observation is for grating spectroscopy of 30 Ari, a late-type star with very high metallicity. The goal is to use extreme cases to help understand how abundances change from the photosphere to the corona. The only progress is to report to date is preparation for the analysis of the data. The SAO team has produced spectral model predictions for comparison with the observed spectra. The target was obtained by X-ray Multimirror Mission (XMM)-Newton on 2001 January 16 for 28000 sec. Pipeline processing is difficult and the data have not yet been available. Furthermore, we have been cautioned that the data cannot be correctly processed until at least September of this year, as there are problems with the RGS software to extract the spectrum. We have attended two workshops this summer in which results from XMM on late-type stellar coronae were presented including SMM results from GT team members. We noted that only members of the instrument teams are in a position to analyze XMM data.

Brickhouse, N.↗

Physics-Informed Recurrent Neural Networks to Predict Reactor Operations of the AGN-201 Nuclear Reactor

4 page paper submitted to ANS Student conference. Summary of paper similar to the following abstract: The ability to predict how a reactor will operate, understand when anomalous conditions arise, and ensure a reactor is being operated as expected is crucial for deploying new nuclear facilities. Digital twins serve as a unique solution to recognizing reactor behavior; however, they require data to be useful. For next-generation reactors, this data may not currently be available. To explore how synthetic physics-informed reactor data can be used to predict reactor operations, a recurrent neural network was implemented for the Idaho State University AGN-201 digital twin. The goal of this work is to determine how synthetic data can be used to train a recurrent neural network model for predicting the reactor power of the AGN-201. The recurrent neural network was validated using both synthetic and real operational data. We envision this approach will help bridge the gap between the virtual and physical sides of a digital twin, where reactor physics models based on as-built data can be corrected for actual operating parameters to ensure the virtual model mirrors reality.

98 NUCLEAR DISARMAMENT, SAFEGUARDS, AND PHYSICAL P↗