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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 37 records · Page 2

prprad (a1)

The portable radiation package (PRP) is an instrument suite to collect atmospheric radiation measurements on a moving platform. The instrument suite consists of a precision spectral pyranometer (PSP), precision infrared radiometer (PIR), and continuously rotating shadowband radiometer.

54 ENVIRONMENTAL SCIENCES↗

rp (a1)

For ship-based deployments, some instruments require actively stabilized platforms to compensate for the ship's motion, especially rotations around the long axis of the ship (roll), short axis (pitch), and, for some instruments, vertical axis (yaw). ARM currently employs two types of stabilized platforms: one electrically controlled for lighter instruments that includes yaw control (dubbed RPY for Roll, Pitch, Yaw) and one hydraulic platform with three independently controlled legs for heavier instruments, like the Marine W-Band ARM Cloud Radar (MWACR), (dubbed RPH for Roll, Pitch, Heave [vertical translational motion]). For a comprehensive report on the purpose, characteristics, and functionality of the RPH hydraulic stabilized platform, see this Report on the Second ARM Mobile Facility (AMF2) Roll, Pitch, and Heave (RPH) Stabilization Platform: Design and Evaluation. For further details of the platform's electronics, configuration, and performance evaluation, see this Report on the Second ARM Mobile Facility (AMF2) Stabilization Platform: Control Strategy and Implementation.

54 ENVIRONMENTAL SCIENCES↗

1sprptcm (a1)

The portable radiation package (PRP) is an instrument suite to collect atmospheric radiation measurements on a moving platform. The instrument suite consists of a precision spectral pyranometer (PSP), precision infrared radiometer (PIR), and continuously rotating shadowband radiometer.

54 ENVIRONMENTAL SCIENCES↗

prptcm (a1)

The portable radiation package (PRP) is an instrument suite to collect atmospheric radiation measurements on a moving platform. The instrument suite consists of a precision spectral pyranometer (PSP), precision infrared radiometer (PIR), and continuously rotating shadowband radiometer.

54 ENVIRONMENTAL SCIENCES↗

rphcontrol (a1)

For ship-based deployments, some instruments require actively stabilized platforms to compensate for the ship's motion, especially rotations around the long axis of the ship (roll), short axis (pitch), and, for some instruments, vertical axis (yaw). ARM currently employs two types of stabilized platforms: one electrically controlled for lighter instruments that includes yaw control (dubbed RPY for Roll, Pitch, Yaw) and one hydraulic platform with three independently controlled legs for heavier instruments, like the Marine W-Band ARM Cloud Radar (MWACR), (dubbed RPH for Roll, Pitch, Heave [vertical translational motion]). For a comprehensive report on the purpose, characteristics, and functionality of the RPH hydraulic stabilized platform, see this Report on the Second ARM Mobile Facility (AMF2) Roll, Pitch, and Heave (RPH) Stabilization Platform: Design and Evaluation. For further details of the platform's electronics, configuration, and performance evaluation, see this Report on the Second ARM Mobile Facility (AMF2) Stabilization Platform: Control Strategy and Implementation.

54 ENVIRONMENTAL SCIENCES↗

rphtilt (a1)

For ship-based deployments, some instruments require actively stabilized platforms to compensate for the ship's motion, especially rotations around the long axis of the ship (roll), short axis (pitch), and, for some instruments, vertical axis (yaw). ARM currently employs two types of stabilized platforms: one electrically controlled for lighter instruments that includes yaw control (dubbed RPY for Roll, Pitch, Yaw) and one hydraulic platform with three independently controlled legs for heavier instruments, like the Marine W-Band ARM Cloud Radar (MWACR), (dubbed RPH for Roll, Pitch, Heave [vertical translational motion]). For a comprehensive report on the purpose, characteristics, and functionality of the RPH hydraulic stabilized platform, see this Report on the Second ARM Mobile Facility (AMF2) Roll, Pitch, and Heave (RPH) Stabilization Platform: Design and Evaluation. For further details of the platform's electronics, configuration, and performance evaluation, see this Report on the Second ARM Mobile Facility (AMF2) Stabilization Platform: Control Strategy and Implementation.

54 ENVIRONMENTAL SCIENCES↗

nav (a1)

On sea-based mobile ARM deployments, several instruments depend on the ship’s current position and "attitude". The NAV system reads the ship’s current position (latitude and longitude) as well as its "attitude" (roll, pitch, and yaw angles). This data is collected for both near-real-time and post-deployment processing of instrument data.

54 ENVIRONMENTAL SCIENCES↗

Navigation and Meteorological Data from Multiple Sensors on Airborne Platform (NAVMET-AIR) Value-Added Product Report

The Navigation and Meteorological Data from Multiple Sensors on Airborne Platform (NAVMET-AIR) value-added product encompasses the aafnaviwg data set in the ARM Data Center (ADC), known as the IWG file, named for the Inter-Agency Working Group for Airborne Data and Telemetry Systems (IWGADTS). Its purpose is to produce a suite of tools to promote standardization of instrument interface, data format, and data processing. This data set’s contents are navigational and meteorological state variables at 1 Hz. It also contains higher-order data flags created by ARM Aerial Facility (AAF) scientists to aid analysis such as periods when the aircraft is flying level, operating in maneuvers, or flying through cloud. Due to the nature of research flights, the payload of the aircraft consists of many duplicate and overlapping instruments to ensure, in case of instrument failure, there is a backup to record the data. Measurements from multiple instruments are consolidated into a single file. Each variable of this data set is carefully chosen from the onboard instrumentation and quality checked by AAF scientists to create this wholistic and most accurate data set for airborne research. This document is intended to be a hub towards the individual “read me” files produced for each campaign. For reference about what instrument was used for calculations on specific days, the read me files are located in the ARM IOP archive at the addresses listed, or access the IOP (intensive operational period) database at https://www.archive.arm.gov/.

54 ENVIRONMENTAL SCIENCES↗

Magnetic Navigation for GPS-Denied Airborne Applications

Most current flight systems are dependent on GPS for navigation. Recently, however, navigation in GPS-denied environments has become an area of intensive research. Additional navigation sensor data can be obtained from visual observations (stars or terrain), inertial measurement units, radar, measurements of the local magnetic field, or perhaps even gravity. Absolute and relative positioning via magnetic field measurements have been shown to be viable in many applications including ground navigation, low altitude aircraft flight, and spaceflight. There is greater variability in the magnetic field over shorter distances when flying at low altitude and in ground applications, leading to more accurate positioning. However, ground-based magnetic navigation is often heavily influenced by man-made structures, especially in urban environments. This is not the case for airborne magnetic navigation since the influence of buildings, roads, etc. is negligible for typical aircraft altitudes. For absolute magnetic navigation, the positioning accuracy decreases as altitude increases for a given vehicle velocity, but the observed time variability in the field can be reclaimed by traveling faster through the field. Thus, navigation accuracy becomes a balance of speed and altitude since the higher altitude can be counterbalanced by higher velocity. To understand these effects quantitatively, we explored various techniques to aid a simulated inertial measurement unit with magnetic information. Using a technique known as two-dimensional magnetic map matching, we simulated the performance of airborne magnetic navigation at fixed speed while varying the altitude, flight direction, magnetometer data collection time, reference magnetic map bias error, and type of trajectory (over land or over ocean).

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

FLIP for FLAG model visualization

A graphical user interface has been developed for FLAG users. FLIP (FLAG Input deck Parser) provides users with an organized view of FLAG models and a means for efficiently and easily navigating and editing nodes, parameters, and variables.

97 MATHEMATICS AND COMPUTING↗

Exploring Time-Varying Multivariate Volume Data Using Matrix of Isosurface Similarity Maps

We present a novel visual representation and interface named the matrix of isosurface similarity maps (MISM) for effective exploration of large time-varying multivariate volumetric data sets. MISM synthesizes three types of similarity maps (i.e., self, temporal, and variable similarity maps) to capture the essential relationships among isosurfaces of different variables and time steps. Additionally, it serves as the main visual mapping and navigation tool for examining the vast number of isosurfaces and exploring the underlying time-varying multivariate data set. We present temporal clustering, variable grouping, and interactive filtering to reduce the huge exploration space of MISM. In conjunction with the isovalue and isosurface views, MISM allows users to identify important isosurfaces or isosurface pairs and compare them over space, time, and value range. More importantly, we introduce path recommendation that suggests, animates, and compares traversal paths for effectively exploring MISM under varied criteria and at different levels-of-detail. A silhouette-based method is applied to render multiple surfaces of interest in a visually succinct manner. We demonstrate the effectiveness of our approach with case studies of several time-varying multivariate data sets and an ensemble data set, and evaluate our work with two domain experts.

97 MATHEMATICS AND COMPUTING↗

An efficient hybrid downscaling framework to estimate high-resolution river hydrodynamics

Flow depth and velocity are the most important hydrodynamic variables that govern various river functions, including water resources, navigation, sediment transport, and biogeochemical cycling. Existing high-resolution flow depth simulations rely on either computationally expensive river hydrodynamic models (RHMs) or data-driven models with formidable training costs, whereas data-driven modeling of flow velocity has rarely been explored. Here, using the hybrid Low-fidelity, Spatial analysis, and Gaussian process learning (LSG) model, we developed a downscaling approach to construct high-resolution flow depth and velocity from a two-dimensional (2-D) RHM simulation at coarse resolution. The LSG models were trained and tested in an urban watershed in Houston using two different hurricane-driven flood events. The high-resolution (as fine as 30 m resolution) and low-resolution (mostly 1000 m resolution) meshes include 664 724 and 14 536 grid cells, respectively. The results showed that through downscaling, the simulation errors were reduced to less than one-fourth and one-third of the errors of the low-resolution 2-D RHM for flow depth and velocity, respectively. Our analysis further revealed that the dominant uncertainty sources of the downscaled hydrodynamics are different, with flow velocity dominated by the dimensionality reduction error, which we reduced by using a regionalized training procedure. The downscaling approach achieves an 84-fold acceleration in computational time compared to the high-resolution 2-D RHM, making high-fidelity ensemble flood modeling feasible. More importantly, the developed method provides an opportunity to couple large-scale hydrodynamical processes with local physical, chemical, and biological processes in river models.

Tan, Zeli [Pacific Northwest National Laboratory (↗

Navigating Transition-Metal Chemical Space: Artificial Intelligence for First-Principles Design

Conspectus The variability of chemical bonding in open-shell transition-metal complexes not only motivates their study as functional materials and catalysts but also challenges conventional computational modeling tools. Here, tailoring ligand chemistry can alter preferred spin or oxidation states as well as electronic structure properties and reactivity, creating vast regions of chemical space to explore when designing new materials atom by atom. Although first-principles density functional theory (DFT) remains the workhorse of computational chemistry in mechanism deduction and property prediction, it is of limited use here. DFT is both far too computationally costly for widespread exploration of transition-metal chemical space and also prone to inaccuracies that limit its predictive performance for localized d electrons in transition-metal complexes. These challenges starkly contrast with the well-trodden regions of small-organic-molecule chemical space, where the analytical forms of molecular mechanics force fields and semiempirical theories have for decades accelerated the discovery of new molecules, accurate DFT functional performance has been demonstrated, and gold-standard methods from correlated wavefunction theory can predict experimental results to chemical accuracy. The combined promise of transition-metal chemical space exploration and lack of established tools has mandated a distinct approach. In this Account, we outline the path we charted in exploration of transition-metal chemical space starting from the first machine learning (ML) models (i.e., artificial neural network and kernel ridge regression) and representations for the prediction of open-shell transition-metal complex properties. The distinct importance of the immediate coordination environment of the metal center as well as the lack of low-level methods to accurately predict structural properties in this coordination environment first motivated and then benefited from these ML models and representations. Once developed, the recipe for prediction of geometric, spin state, and redox potential properties was straightforwardly extended to a diverse range of other properties, including in catalysis, computational “feasibility”, and the gas separation properties of periodic metal–organic frameworks. Interpretation of selected features most important for model prediction revealed new ways to encapsulate design rules and confirmed that models were robustly mapping essential structure–property relationships. Encountering the special challenge of ensuring that good model performance could generalize to new discovery targets motivated investigation of how to best carry out model uncertainty quantification. Distance-based approaches, whether in model latent space or in carefully engineered feature space, provided intuitive measures of the domain of applicability. With all of these pieces together, ML can be harnessed as an engine to tackle the large-scale exploration of transition-metal chemical space needed to satisfy multiple objectives using efficient global optimization methods. In practical terms, bringing these artificial intelligence tools to bear on the problems of transition-metal chemical space exploration has resulted in ML-model assessments of large, multimillion compound spaces in minutes and validated new design leads in weeks instead of decades.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Multivariate Bayesian Optimization of CoO Nanoparticles for CO 2 Hydrogenation Catalysis

The hydrogenation of CO 2 holds promise for transforming the production of renewable fuels and chemicals. However, the challenge lies in developing robust and selective catalysts for this process. Transition metal oxide catalysts, particularly cobalt oxide, have shown potential for CO 2 hydrogenation, with performance heavily reliant on crystal phase and morphology. Achieving precise control over these catalyst attributes through colloidal nanoparticle synthesis could pave the way for catalyst and process advancement. Yet, navigating the complexities of colloidal nanoparticle syntheses, governed by numerous input variables, poses a significant challenge in systematically controlling resultant catalyst features. We present a multivariate Bayesian optimization, coupled with a data-driven classifier, to map the synthetic design space for colloidal CoO nanoparticles and simultaneously optimize them for multiple catalytically relevant features within a target crystalline phase. The optimized experimental conditions yielded small, phase-pure rock salt CoO nanoparticles of uniform size and shape. These optimized nanoparticles were then supported on SiO 2 and assessed for thermocatalytic CO 2 hydrogenation against larger, polydisperse CoO nanoparticles on SiO 2 and a conventionally prepared catalyst. The optimized CoO/SiO 2 catalyst consistently exhibited higher activity and CH 4 selectivity (ca. 98%) across various pretreatment reduction temperatures as compared to the other catalysts. This remarkable performance was attributed to particle stability and consistent H* surface coverage, even after undergoing the highest temperature reduction, achieving a more stable catalytic species that resists sintering and carbon occlusion.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Characterizing Sierra Nevada Snowpack Using Variable-Resolution CESM

The location, timing, and intermittency of precipitation in California make the state integrally reliant on winter-season snowpack accumulation to maintain its economic and agricultural livelihood. Of particular concern is that winter-season snowpack has shown a net decline across the western United States over the past 50 years, resulting in major uncertainty in water-resource management heading into the next century. Cutting-edge tools are available to help navigate and preemptively plan for these uncertainties. This paper uses a next-generation modeling technique-variable-resolution global climate modeling within the Community Earth System Model (VR-CESM)-at horizontal resolutions of 0.125° (14 km) and 0.25° (28 km). VR-CESM provides the means to include dynamically large-scale atmosphere-ocean drivers, to limit model bias, and to provide more accurate representations of regional topography while doing so in a more computationally efficient manner than can be achieved with conventional general circulation models. This paper validates VR-CESM at climatological and seasonal time scales for Sierra Nevada snowpack metrics by comparing them with the "Daymet," "Cal-Adapt," NARR, NCEP, and North American Land Data Assimilation System (NLDAS) reanalysis datasets, the MODIS remote sensing dataset, the SNOTEL observational dataset, a standard-practice global climate model (CESM), and a regional climate model (WRF Model) dataset. Overall, given California's complex terrain and intermittent precipitation and that both of the VR-CESM simulations were only constrained by prescribed sea surface temperatures and data on sea ice extent, a 0.68 centered Pearson product-moment correlation, a negative mean SWE bias of < 7 mm, an interquartile range well within the values exhibited in the reanalysis datasets, and a mean December-February extent of snow cover that is within 7% of the expected MODIS value together make apparent the efficacy of the VR-CESM framework.

54 ENVIRONMENTAL SCIENCES↗

Monte Carlo Simulation with CAD Interface for Calculation of 3D Maps of Residual Dose (CRADA)

Objective: To develop an easy-to-use software application to predict and mitigate radiation effects in research environment, space instruments, nuclear plants and medical facilities and help nonproliferation and national security efforts. Tech-X will develop standalone software libraries and command-line tools for ( 1) translating CAD into tessellated surfaces and tetrahedral meshes in GDML (for Geant4 and MARS 15), ROOT (for MARS 15) and HDF5 (for compact representation and for the visualization) formats, (2) healing CAD geometries to make them suitable for Monte Carlo simulations; (3) creating uniform and variable Cartesian and cylindrical meshes for detailed scoring; and ( 4) efficient Monte Carlo navigation in CAD geometries. JLAB will finish automation of simulations of residual dose in CAD geometries and integrate Tech-X software into Geant4 and MARS15. Finally, Tech-X will develop a Graphical User Interface to set up and heal CAD geometries, create input files, run and visualize simulations for residual dose. This application will run on local desktops, local and remote clusters and supercomputers and will be made available through public clouds, such as Amazon Web Services.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

GPS-Free Navigation in Buildings - NA-241_2018_final_report_SBLibby_12_31_18

This project’s purpose is to evaluate candidate navigation solutions for GPS free inspection tools that can be used in tours of large building interiors. While the IAEA is currently using a system (ANPS – autonomous navigational and positioning sensor) that provides a satisfactory solution under ideal conditions for tours up to one hour, significant improvements for longer tours under variable conditions (also including the added features of on-board processing and time synchronization) are needed. In principle, next generation COTS portable inertial measurement unit (IMU) sensors with satisfactory accuracy, SWAP (size, weight, power), low error, and bias drift can provide sufficiently accurate dead reckoning navigation in a lengthy tour of a large building in the absence of GPS.

42 ENGINEERING↗