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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 127 records · Page 7

Understanding Performance-Quality Trade-offs in Scientific Visualization Workflows with Lossy Compression

The cost of I/O is a significant challenge on current supercomputers, and the trend is likely to continue into the foreseeable future. This challenge is amplified in scientific visualization because of the requirement to consume large amounts of data before processing can begin. Lossy compression has become an important technique in reducing the cost of performing I/O. In this paper we consider the implications of using compressed data for visualization within a scientific workflow. We use visualization operations on simulation data that is reduced using three different state-of-the-art compression techniques. We study the storage efficiency and preservation of visualization features on the resulting compressed data, and draw comparisons between the three techniques used. Our contributions can help inform both scientists and researchers in the use and design of compression techniques for preservation of important visualization details.

Chen, Jieyang↗

Understanding the Computing and Analysis Needs for Resiliency of Power Systems from Severe Weather Impacts

As the frequency and intensity of severe weather has increased, its effect on the electric grid has manifested in the form of significantly more and larger outages in the United States. This has become especially true for regions that were previously isolated from weather extremes. In this paper, we analyze the weather impacts on the electric power grid across a variety of weather conditions, draw correlations, and provide practical insights into the operational state of these systems. High resolution computational modeling of specific meteorological variables, computational approaches to solving power system models under these conditions, and the types of resiliency needs are highlighted as goal-oriented computing approaches are being built to address grid resiliency needs. An example analysis correlating outages to 1km day-ahead weather from two historical winter storms, calculated on a large cluster using a combination of interpolated and extrapolated inputs from multiple instrumented sites to workflows that produce primary meteorological outputs, is shown as initial proof of concept.

analysis↗

Understanding oxidation of Fe-Cr-Al alloys through explainable artificial intelligence

Abstract The oxidation resistance of FeCrAl based on alloying composition and oxidizing conditions is predicted using a combinatorial experimental and artificial intelligence approach. A neural network (NN) classification model was trained on the experimental FeCrAl dataset produced at GE Research. Furthermore, using the SHapley Additive exPlanations (SHAP) explainable artificial intelligence (XAI) tool, we explore how the NN can showcase further material insights that are unavailable directly from a black-box model. We report that high Al and Cr content forms protective oxide layer, while Mo in FeCrAl creates thick unprotective oxide scale that is vulnerable to spallation due to thermal expansion. Graphical abstract

Materials Science↗

Space Telescope and Optical Reverberation Mapping Project. VII. Understanding the Ultraviolet Anomaly in NGC 5548 with X-Ray Spectroscopy

During the Space Telescope and Optical Reverberation Mapping Project observations of NGC 5548, the continuum and emission-line variability became decorrelated during the second half of the six-month-long observing campaign. Here we present Swift and Chandra X-ray spectra of NGC 5548 obtained as part of the campaign. The Swift spectra show that excess flux (relative to a power-law continuum) in the soft X-ray band appears before the start of the anomalous emission-line behavior, peaks during the period of the anomaly, and then declines. This is a model-independent result suggesting that the soft excess is related to the anomaly. We divide the Swift data into on- and off-anomaly spectra to characterize the soft excess via spectral fitting. The cause of the spectral differences is likely due to a change in the intrinsic spectrum rather than to variable obscuration or partial covering. The Chandra spectra have lower signal-to-noise ratios, but are consistent with the Swift data. Our preferred model of the soft excess is emission from an optically thick, warm Comptonizing corona, the effective optical depth of which increases during the anomaly. This model simultaneously explains all three observations: the UV emission-line flux decrease, the soft-excess increase, and the emission-line anomaly.

79 ASTRONOMY AND ASTROPHYSICS↗

Understanding Material Property Impacts on Co-Current Flame Spread: Improving Understanding Crucial for Fire Safety

The prospect of long-term manned space flight brings fresh urgency to the development of an integrated and fundamental approach to the study of material flammability. Currently, NASA uses two tests, the upward flame propagation test and heat and visible smoke release rate test, to assess the flammability properties of materials to be used in space under microgravity conditions. The upward flame propagation test can be considered in the context of the 2-D analysis of Emmons. This solution incorporates material properties by a "mass transfer number", B in the boundary conditions.

Ruff, Gary↗

Heliophysics 2009 Roadmap and Global Change: Possibilities for Improved Understanding of the Connection

Heliophysics is the science that includes all aspects of the research needed to understand the Sun and its effects on the Earth and the solar system. Six science targets: 1. Origins of Near-Earth Plasma - to understand the origin and transport of terrestrial plasma from its source to the magnetosphere and solar wind. 2. Solar Energetic Particle Acceleration and Transport - to understand how and where solar eruptions accelerate energetic particles that reach Earth. 3. Ion-Neutral Coupling in the Atmosphere - to understand how neutral winds control ionospheric variability. 4. Climate Impacts of Space Radiation - to understand our atmosphere s response to auroral, radiation belt, and solar energetic particles, and the associated effects on nitric oxide (NO) and ozone. 5. Dynamic Geospace Coupling - to understand how magnetospheric dynamics provides energy into the coupled ionosphere-magnetosphere system. 6. Heliospheric Magnetics - to understand the flow and dynamics of transient magnetic structures form the solar interior to Earth.

Spann, Jim↗

Measurements and modeling of CO 2 concentration and isotopes to improve process-level understanding of Arctic and boreal carbon cycling. Final Report

The major goal of this project was to improve understanding of processes that control the exchanges of CO 2 between the atmosphere and the land biosphere on decadal and longer time scales. The approach involves measuring the changes in atmospheric CO 2 concentration and the isotopes of CO 2 ( 13 C/ 12 C and 18 O/ 16 O) at background stations and uses these and other datasets to challenge and improve numerical models of the earth system. The project particularly emphasized the use of these data to improve understanding of changes occurring in boreal and arctic ecosystems over the past 50 years and to seek from these data improved understanding of large-scale processes impacting carbon cycling, such as the responses to warming, CO 2 fertilization, and disturbance. The project also led to advances in the understanding of changes in water-use efficiency of land ecosystems globally based on trends in 13 C/ 12 C. The core element of this project was providing partial support for continuing measurements of CO 2 concentrations and isotopes from the Scripps CO 2 program, initiated by C. D. Keeling in the 1960s. The measurements included analysis of flasks collected at an array of ten stations distributed from the Arctic to the Antarctic. The project also supported modeling studies and interpretive work to help understand the origins of the large ~50% increase in the amplitude of the atmospheric CO 2 cycle detected at high northern latitudes between 1960 and present and to understand the long-term trend in carbon 13 C/ 12 C of CO 2 . The seasonal cycle work was advanced through collaborations with colleagues at MPI Jena and Imperial College

47 OTHER INSTRUMENTATION↗

Understanding of catalytic transformation of shale gas and development of catalysts with high activity and selectivity through experimental exploration and theoretical simulation

Catalysis on transition metal oxides is equivalently important in contrast to that on metal catalysts in chemical and energy transformations. Understanding of catalytic reactions on early transition metal oxide catalysts is fundamentally intriguing and of great practical interest in efficient production of chemical and fuel feedstocks. Fundamental understanding of catalysis on transition metal oxide-based catalysts has been lagged behind catalysis on metals due to the complexity of chemistry and structure of surface and bulk of oxide catalysts and their structural flexibility in reactive environment at high temperatures. The funded DOE project explored surface chemistry of a few reducible oxides including CeO 2 - based, Co 3 O 4 -based, and CoO-based which are significant for heterogeneous catalysis. Through in-situ studies using ambient pressure X-ray photoelectron spectroscopy and high pressure scanning tunneling microscopy, we revealed phase transformation, the accompanying changes of surface chemistry and structure, and uncovered their correlations with catalytic activity and selectivity in catalytic reactions including reduction of NO with CO, water-gas shift, and chemical transformations of methane to methanol and acetic acid under mild conditions. Driven by the following two facts, we propose to pursue fundamental understanding of oxidative dehydrogenation of ethane and oxidative coupling of methane on oxide catalysts through both in-situ studies of catalyst surfaces during catalysis and computational studies in the renewal proposal. One driving force is the significance of oxidative dehydrogenation of ethane and oxidative coupling of methane for utilization of earth-abundant, relatively inexpensive energy resource and the urgent needs of efficient chemical processes to generate ethylene from shale gas. The other is that exploration of surface chemistry of oxide catalysts during catalysis has remained challenging though it is critical in deeply understanding catalysis on oxide catalysts and developing oxide-based catalysts toward high selectivity and activity. Therefore, the overall objective of the renewal proposal is to mechanistically understand the oxidative dehydrogenation of ethane and oxidative coupling of methane at a molecular level through building correlations between surface chemistry of catalysts during catalysis and the corresponding catalytic performances, and thus design catalysts with high selectivity and activity for production of ethylene with the guidance achieved from these fundamental studies. Experiments were designed to explore the influences of electronic states of cations supported on substrate oxides, cations of surface of the substrate oxides, and surface lattice oxygen atoms of the substrate oxides on their catalytic selectivity and activity. Surface chemistry, including oxidation state of the surface monomers and cations of substrate oxides and density of oxygen vacancies during catalysis, will be tracked with AP-XPS during catalysis. A correlation between surface chemistry of these catalysts at different temperatures and their corresponding catalytic selectivity for production of ethylene and activity will be built. Computational studies will calculate adsorption energies of reactant molecules and their dissociated species and intermediates on the catalyst surface, search transition states, and simulate reaction pathway close to experimental studies. By integrating the computational studies into these correlations to be built from experimental studies, fundamental understanding of the catalytic mechanisms of oxidative dehydrogenation of ethane and oxidative coupling of methane at a molecular level will be achieved. With these insights, new catalysts with high selectivity and activity will be developed.

36 MATERIALS SCIENCE↗

Limitations on the Use of Eye-Tracking Data to Understand Operator Awareness

In the last 20 years, a number of accidents and incidents in commercial aviation have pointed to poor flight crew awareness of basic flight path parameters (e.g., airspeed, bank, pitch). As a result, there is a desire to improve pilot situation awareness and how attention is allocated. Eye-tracking has been a commonly used measure of awareness; it can aid in understanding whether specific indications were fixated, and perhaps how a pilot gathered information (that is, which indications in which sequence). In this paper, we discuss limitations on what eye-tracking data can reveal about pilot awareness and understanding. First, previous studies (e.g., Sarter et al., 2007) have shown that fixation on an indication may not ensure awareness or understanding. Further, an operator may have awareness of information not fixated. Additional measures—such as self-report or control inputs—can help to better establish the extent of pilot awareness and understanding. Second, sequences of fixations (scan patterns) have also become a performance measure. While a small number of recognized scan patterns have been validated for a small set of parameters on the Primary Flight Display (PFD), scan patterns have not been identified to support the broader context of flight path management or flight operations. More important is to understand the full set of drivers underlying the larger pattern of eye fixations; this approach moves away from the idea of well-established scan patterns as a marker of skilled performance and gives a larger role to pilot cognition. Pilots have various reasons to direct attention to specific elements on the interface, such as: - feedback tied to control inputs - a check on compliance with flight path targets - a reaction to an alert or a call out - attempt to understand an unexpected indication - assess progress toward a flight path target The importance of cognition is further implicated in the finding that pilot interviews show that fixating typically is accompanied by expectation; generally, pilots have a strong expectation of what value or indication they will see, which allows more efficient integration of information and an ability to identify indications that suggest an alternative account of the current system state. We will describe a range of eye-tracking measures and how they should and should not be used.

aviation↗

Model Hierarchies for Understanding Atmospheric Circulation

In this review, we highlight the complementary relationship between simple and comprehensive models in addressing key scientific questions to describe Earth's atmospheric circulation. The systematic representation of models in steps, or hierarchies, connects our understanding from idealized systems to comprehensive models and ultimately the observed atmosphere. First, we define three interconnected principles that can be used to characterize the model hierarchies of the atmosphere. We explore the rich diversity within the governing equations in the dynamical hierarchy, the ability to isolate and understand atmospheric processes in the process hierarchy, and the importance of the physical domain and resolution in the hierarchy of scale. We center our discussion on the large-scale circulation of the atmosphere and its interaction with clouds and convection, focusing on areas where simple models have had a significant impact. Our confidence in climate model projections of the future is based on our efforts to ground the climate predictions in fundamental physical understanding. This understanding is, in part, possible due to the hierarchies of idealized models that afford the simplicity required for understanding complex systems.

58 GEOSCIENCES↗

Soil Aggregate Microbial Communities: Towards Understanding Microbiome Interactions at Biologically Relevant Scales

Soils contain a tangle of minerals, water, nutrients, gases, plant roots, decaying organic matter, and microorganisms which work together to cycle nutrients and support terrestrial plant growth. Most soil microorganisms live in periodically interconnected communities closely associated with soil aggregates, i.e., small (<2 mm), strongly bound clusters of minerals and organic carbon that persist through mechanical disruptions and wetting events. Their spatial structure is important for biogeochemical cycling, and we cannot reliably predict soil biological activities and variability by studying bulk soils alone. To fully understand the biogeochemical processes at work in soils, it is necessary to understand the micrometer-scale interactions that occur between soil particles and their microbial inhabitants. Here, we review the current state of knowledge regarding soil aggregate microbial communities and identify areas of opportunity to study soil ecosystems at a scale relevant to individual cells. We present a framework for understanding aggregate communities as “microbial villages” that are periodically connected through wetting events, allowing for the transfer of genetic material, metabolites, and viruses. Here, we describe both top-down (whole community) and bottom-up (reductionist) strategies for studying these communities. Understanding this requires combining “model system” approaches (e.g., developing mock community artificial aggregates), field observations of natural communities, and broader study of community interactions to include understudied community members, like viruses. Initial studies suggest that aggregate-based approaches are a critical next step for developing a predictive understanding of how geochemical and community interactions govern microbial community structure and nutrient cycling in soil.

54 ENVIRONMENTAL SCIENCES↗

Understanding the engines and progenitors of gamma-ray bursts

Our understanding of the engines and progenitors of gamma-ray bursts has expanded through the ages as a broader set of diagnostics has allowed us to test our understanding of these objects. In this work, we review the history of the growth in our understanding, focusing on 3 leading engines and 9 potential progenitors. The first gravitational wave detection of a short burst is the latest in a series of breakthrough observations shaping this understanding and we study the importance of multi-diagnostic, multi-messenger observations on these engines and their progenitors. Our understanding based on a detailed study of nearby bursts can be applied to make predictions for the trends expected as we begin to observe high redshift bursts and we discuss these trends.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Understanding and Constraining the Midlatitude Cloud Optical Depth Feedback in Climate Models (Final Report)

The objectives of this investigation are to provide a deeper understanding of the brightening of middle and high latitude clouds that occurs in many climate models as the climate warms, and to better understand why models give varying estimates of the strength of this negative feedback. The investigation may also provide new information on why models are deficient in their simulation of the present day clouds in these regions. The analysis will reveal which models simulate current clouds most realistically in the regions of interest, and relate this to the strength of the cloud feedbacks in the models. This will improve the uncertainty quantification of climate simulations and will provide theoretical understanding potentially leading to increased reliability of climate change projections. This will enhance the predictive understanding of the Earth system by analyzing the natural and anthropogenic components of global climate change in models. The primary methods involve the study of the clouds in the suite of CMIP5 model climate simulations and comparison of clouds in climate simulations with data from satellite measurement systems, with a particular emphasis on mixed-phase cloud physics, for which ice and water are present simultaneously. State-of-the-art climate model feedback analysis will be combined with new and more comprehensive observations of clouds available from modern measurement systems. Novel use of model simulations in combination with observations enables a deeper understanding of the role of clouds in climate change. Metrics that facilitate model-to-model and model-to-observation comparisons related to mixed-phase cloud physics will be developed and used to highlight challenges and opportunities for improving the state-of-the-science models. This investigation is a collaboration between the University of Washington, where the data work is concentrated and LLNL where the model data and the tools and expertise to do cloud feedback analysis are located. The grant supported the work of 3 different graduate students at different times (McCoy, Wall and Berry) Post-doctoral researcher Blaž Gasparini was also partially supported on this grant and led our collaboration with PNNL scientists. PNNL scientists also collaborated in the work of graduate student Wall (Po-Lun Ma). The main results of our research efforts are reported in 6 papers and 1 book chapter that were supported by this grant.

54 ENVIRONMENTAL SCIENCES↗