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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 469 records · Page 26

The ACTS Flight System - Cost-Effective Advanced Communications Technology

The multibeam communications package (MCP) for the Advanced Communications Technology Satellite (ACTS) to be STS-launched by NASA in 1988 for experimental demonstration of satellite-switched TDMA (at 220 Mbit/sec) and baseband-processor signal routing (at 110 or 27.5 Mbit/sec) is characterized. The developmental history of the ACTS, the program definition, and the spacecraft-bus and MCP parameters are reviewed and illustrated with drawings, block diagrams, and maps of the coverage plan. Advanced features of the MPC include 4.5-dB-noise-figure 30-GHz FET amplifiers and 20-GHz TWTA transmitters which provide either 40-W or 8-W RF output, depending on rain conditions. The technologies being tested in ACTS can give frequency-reuse factors as high as 20, thus greatly expanding the orbit/spectrum resources available for U.S. communications use.

Holmes, W. M., Jr.↗

pyDiSCaMB : enabling the use of multipolar scattering factors in Phenix

Multipolar scattering models, such as the transferable aspherical atom model, account for atomic chemical interactions and provide a more accurate representation of experimental data. However, the simpler independent atom model (IAM), which assumes non-interacting atoms, is the only model available in the most widely used macromolecular refinement programs. This is primarily because IAM offers a hard-to-beat combination of computational efficiency and modelling power at typical macromolecular resolutions. By contrast, more accurate multipolar modelling has historically been limited due to its computational cost and the absence of an interface between software capable of calculating structure factors and gradients based on multipolar models and software designed for macromolecular refinement. This work introduces pyDiSCaMB , a Python software package designed to integrate between the computational crystallography toolbox ( cctbx ) and the quantum crystallography library DiSCaMB ( Densities in Structural Chemistry and Molecular Biology ), thus enabling multipolar scattering models in Phenix 's toolkit. The implementation, features and capabilities of pyDiSCaMB are presented, the runtimes for the calculation of structure factor and target gradients with respect to atomic parameters are explored, and Fourier images of electrostatic potential, electron density and deformation maps are computed as illustrative examples. The pyDiSCaMB library will make multipolar modelling widely available to the structural biology community, potentially transforming refinement and model-building for both crystallography and cryogenic electron microscopy (cryoEM).

MATTS data bank↗

Argo NodeOS: Toward Unified Resource Management for Exascale

Exascale systems are expected to feature hundreds of thousands of compute nodes with hundreds of hardware threads and complex memory hierarchies with a mix of on-package and persistent memory modules. In this context, the Argo project is developing a new operating system for exascale machines. Targeting production workloads using workflows or coupled codes, we improve the Linux kernel on several fronts. We extend the memory management of Linux to be able to subdivide NUMA memory nodes, allowing better resource partitioning among processes running on the same node. We also add support for memory-mapped access to node- local, PCIe-attached NVRAM devices and introduce a new scheduling class targeted at parallel runtimes supporting user- level load balancing.

Perarnau, Swann↗

Chama v. 0.1 (beta version)

Chama is a python package which includes mixed-integer, stochastic programming formulations to determine sensor locations and technology that maximize the effectiveness of a detection program. The software includes the ability to (1) generate concentration profiles using a Gaussian Plume model, (2), define a wide range of sensor technology, including stationary and mobile sensors, point detectors and cameras, (3) optimize sensor location and type using coverage or impact statistics, and (4) generate maps of the site that include concentration plumes and sensor layout.

Klise, Katherine↗

Fourier-based methods for removing mesh anomalies from angle resolved photoemission spectra

Recent improvements to spatial resolution in angle-resolved photo-emission spectroscopy (ARPES) have made it common to perform measurements with a very brief dwell time, for the purpose of mapping the spectral function over large surface regions. However, rapid measurement modalities can suffer a grid-like intensity modulation due to a wire mesh that is typically placed in front of the ARPES detector to block stray electrons. Here, we explore Fourier-based methods that can effectively remove this artifact, and improve the quality of ARPES images obtained in rapid scanning modes. In conclusion, an open source software package is provided containing implementations of demonstrated algorithms.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Distributed Sapphire Fiber Bragg Gratings Based Thermal Profiling of Submerged Entry Nozzles

This research focuses on the application of sapphire fiber Bragg gratings (FBGs) for instrumentation in submerged entry nozzles (SEN) within the steelmaking industry. The SEN is pivotal for transferring molten steel from a tundish to a mold, while preventing the infiltration of oxygen and nitrogen from the surrounding environment. Maintaining optimal flow conditions in the mold is crucial for ensuring casting process stability and maintaining high quality steel. Sapphire FBG sensors have been instrumented in SENs to enable distributed thermal mapping for monitoring the health of the SEN. The optical sensor comprises three cascaded sapphire FBGs inscribed using femtosecond laser technology into a one-meter-long sapphire crystalline fiber. The sensor underwent characterization in a laboratory setting up to 1600°C and was tested for long-term stability over 40 hours under extreme environmental conditions. The coupling between silica and sapphire fibers was investigated and implemented during sensor packaging. Here, the sensor successfully captured the pre-heat sequence of the SEN in real-world steelmaking operations. Compared to conventional thermocouples, sapphire FBG sensors demonstrated exceptional efficiency and precision. They offer potential benefits such as increased productivity, reduced energy consumption, and minimized carbon footprint in the steel industry.

Sapphire Fiber Bragg Grating↗

Toward adaptive radiotherapy for head and neck patients: Feasibility study on using CT-to-CBCT deformable registration for “dose of the day” calculations

Purpose: The aim of this study was to evaluate the appropriateness of using computed tomography (CT) to cone-beam CT (CBCT) deformable image registration (DIR) for the application of calculating the “dose of the day” received by a head and neck patient. Methods: NiftyReg is an open-source registration package implemented in our institution. The affine registration uses a Block Matching-based approach, while the deformable registration is a GPU implementation of the popular B-spline Free Form Deformation algorithm. Two independent tests were performed to assess the suitability of our registrations methodology for “dose of the day” calculations in a deformed CT. A geometric evaluation was performed to assess the ability of the DIR method to map identical structures between the CT and CBCT datasets. Features delineated in the planning CT were warped and compared with features manually drawn on the CBCT. The authors computed the dice similarity coefficient (DSC), distance transformation, and centre of mass distance between features. A dosimetric evaluation was performed to evaluate the clinical significance of the registrations errors in the application proposed and to identify the limitations of the approximations used. Dose calculations for the same intensity-modulated radiation therapy plan on the deformed CT and replan CT were compared. Dose distributions were compared in terms of dose differences (DD), gamma analysis, target coverage, and dose volume histograms (DVHs). Doses calculated in a rigidly aligned CT and directly in an extended CBCT were also evaluated. Results: A mean value of 0.850 in DSC was achieved in overlap between manually delineated and warped features, with the distance between surfaces being less than 2 mm on over 90% of the pixels. Deformable registration was clearly superior to rigid registration in mapping identical structures between the two datasets. The dose recalculated in the deformed CT is a good match to the dose calculated on a replan CT. The DD is smaller than 2% of the prescribed dose on 90% of the body's voxels and it passes a 2% and 2 mm gamma-test on over 95% of the voxels. Target coverage similarity was assessed in terms of the 95%-isodose volumes. A mean value of 0.962 was obtained for the DSC, while the distance between surfaces is less than 2 mm in 95.4% of the pixels. The method proposed provided adequate dose estimation, closer to the gold standard than the other two approaches. Differences in DVH curves were mainly due to differences in the OARs definition (manual vs warped) and not due to differences in dose estimation (dose calculated in replan CT vs dose calculated in deformed CT). Conclusions: Deforming a planning CT to match a daily CBCT provides the tools needed for the calculation of the “dose of the day” without the need to acquire a new CT. The initial clinical application of our method will be weekly offline calculations of the “dose of the day,” and use this information to inform adaptive radiotherapy (ART). The work here presented is a first step into a full implementation of a “dose-driven” online ART.

62 RADIOLOGY AND NUCLEAR MEDICINE↗

30-kW Maintenance-Free Stirling Engine for High-Performance Dish Concentrating Solar

This final report summarizes the final results of the 30-kW Maintenance-Free Stirling Engine for High-Performance Dish Concentrating Solar project performed by Infinia Corporation for the U.S. Department of Energy under contract DE-FC36-08GO18032 during the project period of March 1, 2008 – March 31, 2012. Over the course of the project, Infinia Corporation achieved substantial progress in the design, fabrication, assembly, testing and evaluation of a 30-kW multi-cylinder, free-piston Stirling engine (MCFPSE) prototype. In this effort, prior MCFPSE conceptual design approaches were adapted for the development of a 30-kW design, thereby producing a cohesive design package and detailed performance specifications. Numerical analysis using the Stirling Engine Analysis and Optimization Code (SAGE) was completed culminating in the selection of a fully balanced 6-cylinder configuration composed of two 3-cylinder engine modules. The model was refined throughout the program to include all wall conduction losses, piston and rod seal losses, appendix, shuttle and pumping losses, and piston radiation loss to closely represent the real system. Performance mapping of the engine was then completed using the detailed model. Based on knowledge and experience from its existing commercial products, and using the results from the extensive numerical modeling discussed above, Infinia successfully fabricated, assembled and tested two sets of 30-kW engine modules. One of these configurations was driven by an external power supply and operated as a cooler in order to verify the mechanical integrity of the system. In the engine configuration, induction heaters provided the energy to the heater head to operate the engine. Considerable effort was expended on correcting problems associated with contact and rubbing of internal components, identification and subsequent elimination of internal leaks, and undesirable amounts of piston bias. Many details concerning the fabrication and testing efforts are considered proprietary. As a result, those findings are not disclosed herein but rather can be found in proprietary reports supplied to the DOE on a periodic basis. The prototype did not fully demonstrate performance nor did it realize the projected cost targets. Furthermore, the basis of the mechanical and electrical architecture of the 30-kW multi-cylinder prototype design is now at least two generations old. Alternatively, Infinia’s 8-kW Bonneville generator, which was successfully demonstrated in April 2012, and is slated to enter commercial production in late 2013, offers immediate benefits of lower cost and significantly higher power density such that the generator will likely meet DOE’s Sunshot LCOE target goal of $\$$0.07-0.10/kWh by 2015 and $\$$0.05-0.07/kWh by 2020. Therefore, the design of a 30-kW Stirling engine as disclosed in the project will not be pursued further. However, Infinia remains keenly interested in developing higher power Stirling machines in the future based on the new Bonneville mechanical design.

14 SOLAR ENERGY↗

Dynamics Explorer 1 SOI images of the Antarctic ozone hole

The Dynamics Explorer (DE) satellite carries an Auroral Imaging Package which contains filters designed for performing backscatter ultraviolet measurements to measure total column ozone in the Earth's middle and lower atmosphere. Measurements are obtained at 317.5 mm (to measure ozone absorption) and 360 nm (to measure scene reflectivity). In October 1985 and 1986, measurements were obtained near apogee of the Antarctic ozone hole. The only other high spatial resolution measurements were obtained from the Nimbus 7 Total Ozone Mapping Spectrometer (TOMS) experiment. In October 1987, the Dynamics Explorer apogee had precessed into the Northern Hemisphere preventing measurements of the ozone hole. However, measurements should be obtained from DE of the ozone hole in both 1988 and 1989. Considering that the Nimbus 7 TOMS instrument has long exceeded its expected lifetime, the DE Spin Scan Ozone Imager (SOI) experiment could easily play a crucial role in studies of the ozone hole over the next few years.

Keating, G. M.↗

The Multiview Observatory for Solar Terrestrial Science (MOST)

Understanding the emergence of magnetic flux from the solar interior through the photosphere and its global impact on the inner heliosphere is a key scientific goal of the heliophysics community. This white paper outlines the concept of the Multiview Observatory for Solar Terrestrial Science (MOST) mission, which will make measurements of solar variability from the solar interior, atmosphere, and the interplanetary (IP) medium. MOST will be a 4- spacecraft mission with one each at L4 (MOST1) and L5 (MOST2) and the other two (MOST3 and MOST4) at variable locations along Earth orbit. MOST1 and MOST2 will each carry seven remote-sensing and 3 in-situ instruments. All four spacecraft will carry a novel radio package known as the Faraday Effect Tracker of Coronal and Heliospheric structures (FETCH) that will systematically probe the magnetic content of transient IP structures including coronal mass ejections (CMEs) and stream interaction regions (SIRs). The Faraday rotation measurements will provide magnetic content of these structures at various heliocentric distances from the outer corona to Earth’s vicinity. Photospheric and/or chromospheric magnetograms will cover >70% of the solar surface providing synchronic maps needed for accurately modeling the corona and solar wind. EUV, coronagraph, radio spectrograph, and heliospheric imager (HI) observations from multiple viewpoints provide 3-d information on CMEs/CME-driven shocks, SIRs, and other solar wind structures. Hard X-ray imagers will provide the flare aspects of solar eruptions to complement the CME aspects. MOST, a 10-year mission, is well aligned with NASA’s Heliophysics objectives and will provide an unprecedented opportunity to achieve these objectives with broad participation from the heliophysics community.

N. Gopalswamy↗

Comparison of hybrid methods for global variance reduction in shielding calculations

For Monte Carlo shielding problems that calculate a mesh tally over the entire problem, the statistical uncertainties computed for each voxel can vary widely. This can lead to unacceptably long run times in order to reduce the uncertainties in all areas of the problem to a reasonably low level. Hybrid methods - using estimates from deterministic calculations to create importance maps for variance reduction in Monte Carlo calculations - have been successfully used to optimize the calculation of specific tallies. For the global problem, several methods have been proposed to create importance maps that distribute Monte Carlo particles in such a way as to achieve a more uniform distribution of relative uncertainty across the problem. The goal is to compute a mesh tally with nearly the same relative uncertainties in the low flux/dose areas as in the high flux/dose areas. Methods based on only forward deterministic estimates and methods using both forward and adjoint deterministic methods have been implemented in the SCALE/MAVRIC package and have been compared against each other by computing global mesh tallies on several representative shielding problems. Methods using both forward and adjoint estimates provide better performance for computing more uniform relative uncertainties across a global mesh tally. (authors)

97 MATHEMATICS AND COMPUTING↗

SCALE Enhancements for Detailed Cask Dose Rate Analysis - Paper 37

The Nuclear Fuels Storage and Transportation Planning Project and the Used Fuel Disposition Campaign, both under the US Department of Energy (DOE) Office of Nuclear Energy, require the ability to predict k{sub eff}, heat generation and temperature distributions, and external dose rates from any combination of commercial spent nuclear fuel assemblies loaded into any type of licensed cask. Work in the Reactor and Nuclear Systems Division at Oak Ridge National Laboratory has begun to develop the UNF-ST[and]DARDS system (Used Nuclear Fuel Storage, Transportation and Disposal Analysis Resource and Data System) that uses many of the nuclear analysis codes from the SCALE package, a comprehensive database of used nuclear fuel inventories from utilities, and a library of model template files to produce complete input files for the various types of UNF computational analyses. UNF-ST[and]DARDS uses the template files and input parameters that are applicable to a safety analysis to assemble and execute a complete input file, collect the output files and relevant information for subsequent calculations, and illustrate calculation results as a function of decay time and other relevant analysis parameters. This paper will focus on the shielding aspects and the ability to predict external dose rates from as-loaded casks. Realistic dose rate values based on actual canister fuel contents may be used in developing appropriate plans, procedures, and methods to keep personnel radiation exposures as low as reasonably achievable during cask repackaging and transportation operations, as well as in performing total system analyses and transportation risk evaluations. The MAVRIC shielding sequence of the SCALE package was created for the US Nuclear Regulatory Commission for analyzing dose rates outside of storage, transfer, or transportation casks loaded with spent nuclear fuel. MAVRIC contains automated variance reduction capabilities based on the CADIS and FW-CADIS methods that are effective for optimizing deep penetration Monte Carlo shielding problems for achieving low relative uncertainties in short computing times. MAVRIC uses the Denovo discrete ordinates code to compute importance maps and biased source terms for the Monaco fixed-source Monte Carlo code, which can use multi-group or continuous-energy cross section data. ORIGEN (Oak Ridge Isotope Generation and Depletion) is the SCALE computer code for calculating time-dependent isotopic concentrations during irradiation and decay for more than 2,200 nuclides that can be produced by nuclear fuel irradiation and activation. A series of SCALE enhancements was implemented to enable automatic decay heat and radiation source term generation and shielding safety analysis of as-loaded casks. The enhancements to SCALE made under this project will be a part of the SCALE 6.2 release expected in fall 2014. (authors)

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

GPS Software Packages Deliver Positioning Solutions

"To determine a spacecraft s position, the Jet Propulsion Laboratory (JPL) developed an innovative software program called the GPS (global positioning system)-Inferred Positioning System and Orbit Analysis Simulation Software, abbreviated as GIPSY-OASIS, and also developed Real-Time GIPSY (RTG) for certain time-critical applications. First featured in Spinoff 1999, JPL has released hundreds of licenses for GIPSY and RTG, including to Longmont, Colorado-based DigitalGlobe. Using the technology, DigitalGlobe produces satellite imagery with highly precise latitude and longitude coordinates and then supplies it for uses within defense and intelligence, civil agencies, mapping and analysis, environmental monitoring, oil and gas exploration, infrastructure management, Internet portals, and navigation technology."

Source record↗

Washington Play Fairway Analysis Geothermal Heat and Permeability Potential Geodatabases

This file contains file geodatabases of the Mount St. Helens seismic zone (MSHSZ), Wind River valley (WRV) and Mount Baker (MB) geothermal play-fairway sites in the Washington Cascades. The geodatabases include input data (feature classes) and output rasters (generated from modeling and interpolation) from the geothermal play-fairway in Washington State, USA. These data were gathered and modeled to provide an estimate of the heat and permeability potential within the play-fairways based on: mapped volcanic vents, hot springs and fumaroles, geothermometry, intrusive rocks, temperature-gradient wells, slip tendency, dilation tendency, displacement, displacement gradient, max coulomb shear stress, sigma 3, maximum shear strain rate, and dilational strain rate at 200m and 3 km depth. In addition this file contains layer files for each of the output rasters. For details on the areas of interest please see the 'Phase 1 Technical Report' in the download package. This submission also includes a file with the geothermal favorability of the Washington Cascade Range based off of an earlier statewide assessment. Additionally, within this file there are the maximum shear and dilational strain rate rasters for all of Washington State.

15 GEOTHERMAL ENERGY↗

Hamiltonian parameter inference from resonant inelastic x-ray scattering with active learning

Identifying model Hamiltonians is a vital step toward creating predictive models of materials. Here, in this study, we combine Bayesian optimization with the EDRIXS numerical package to infer Hamiltonian parameters from resonant inelastic x-ray scattering (RIXS) spectra within the single atom approximation. To evaluate the efficacy of our method, we test it on experimental RIXS spectra of NiPS 3 , NiCl 2 , Ca 3 ⁢LiOsO 6 , and Fe 2⁢ O 3 , and demonstrate that it can reproduce results obtained from hand-fitted parameters to a precision similar to expert human analysis while providing a more systematic mapping of parameter space. Our work provides a key first step toward solving the inverse scattering problem to extract effective multi-orbital models from information-dense RIXS measurements, which can be applied to a host of quantum materials. We also propose atomic model parameter sets for two materials, Ca 3⁢ LiOsO 6 and Fe 2⁢ O 3 , that were previously missing from the literature.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

A multiscale hydro-geochemical-mechanical approach to analyze faulted CO 2 reservoirs: Original Research Article: A multiscale hydro-geochemical-mechanical approach to analyze faulted CO 2 reservoirs

This paper applies a multiscale hydro-geochemical-mechanical approach to analyze faulted CO 2 reservoirs using the STOMP-CO 2 -R code that is coupled to the ABAQUS® finite element package. STOMP-CO 2 -R models the reactive transport of CO 2 causing mineral volume fraction changes that are captured by an Eshelby-Mori-Tanka model implemented in ABAQUS®. A three-dimensional (3D) STOMP-CO 2 -R model for a reservoir containing an inclined fault was built to analyze a formation containing a reaction network with 5 minerals: albite, anorthite, calcite, kaolinite and quartz. A 3D finite element mesh that exactly maps the STOMP-CO 2 -R grid is developed for coupled hydro-geochemical-mechanical analyses. The model contains alternating sandstone and shale layers. The impact of reactive transport of CO 2 on the geomechanical properties of reservoir rocks and seals are studied in terms of mineral composition changes that affect their geomechanical responses. Simulations assuming extensional and compressional stress regimes with and without coupled geochemistry are performed to study the stress regime effect on the risk of hydraulic fracture. The tendency for the fault to slip is examined in terms of stress regime, geomechanical and geochemical-mechanical effects as well as fault inclination. The results show that mineralogical changes due to long-term injection of CO 2 reduce the permeability and elastic modulus of the reservoir, leading to increased risk of hydraulic fracture in the injection location and at the caprock seal immediately above the injection zone. Fault slip is not predicted to occur. However, fault inclination and stress regime have an important impact on the slip tendency factor.

54 ENVIRONMENTAL SCIENCES↗

THREE-DIMENSIONAL RADIO AND X-RAY MODELING AND DATA ANALYSIS SOFTWARE: REVEALING FLARE COMPLEXITY

Many problems in solar physics require analysis of imaging data obtained in multiple wavelength domains with differing spatial resolution in a framework supplied by advanced three-dimensional (3D) physical models. To facilitate this goal, we have undertaken a major enhancement of our IDL-based simulation tools developed earlier for modeling microwave and X-ray emission. The enhanced software architecture allows the user to (1) import photospheric magnetic field maps and perform magnetic field extrapolations to generate 3D magnetic field models; (2) investigate the magnetic topology by interactively creating field lines and associated flux tubes; (3) populate the flux tubes with user-defined nonuniform thermal plasma and anisotropic, nonuniform, nonthermal electron distributions; (4) investigate the spatial and spectral properties of radio and X-ray emission calculated from the model; and (5) compare the model-derived images and spectra with observational data. The package integrates shared-object libraries containing fast gyrosynchrotron emission codes, IDL-based soft and hard X-ray codes, and potential and linear force-free field extrapolation routines. The package accepts user-defined radiation and magnetic field extrapolation plug-ins. We use this tool to analyze a relatively simple single-loop flare and use the model to constrain the magnetic 3D structure and spatial distribution of the fast electrons inside this loop. We iteratively compute multi-frequency microwave and multi-energy X-ray images from realistic magnetic flux tubes obtained from pre-flare extrapolations, and compare them with imaging data obtained by SDO, NoRH, and RHESSI. We use this event to illustrate the tool's use for the general interpretation of solar flares to address disparate problems in solar physics.

79 ASTRONOMY AND ASTROPHYSICS↗

Axom

The Axom library consists of n collection of software components that provide core computer science infrastructure capabilities that can be shared by diverse high performance computing (HPC) applications. The current set of capabilities that Axom provides includes: Customizable support for error/warning and diagnostic message reporting and coordination among components of integrated applications (e.g., physics packages, libraries, etc.); Scalable parallel aggregation and filtering of message logging; In memory datastore for hierarchical, mesh-aware simulation data. The datastore supports data description, allocation, deallocation. parallel l/0, etc; Mesh data model abstractions that enable the development of mesh-based computational algorithms that work with many diverse, application· specific mesh types; and Computational geometry primitives for developing high performance parallel algorithms based on spatial geometry and meshes, e.g., spatial acceleration data structures, sets, maps, relations, etc.

Hornung, RichardD.↗