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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 631 records · Page 35
All sourcesNASA NTRSDOE OSTI
DOE OSTI2017

Final Report: Archiving Data to Support Data Synthesis of DOE Sponsored Elevated CO 2 Experiments

Over the last three decades DOE made a large investment in field-scale experiments in order to understand the role of terrestrial ecosystems in the global carbon cycle, and forecast how carbon cycling will change over the next century. The Smithsonian Environmental Research Center received one of the first awards in this program and managed two long-term studies (25 years and 10 years) with a total of approximately $10 million of support from DOE, and many more millions leveraged from the Smithsonian Institution and agencies such as NSF. The present DOE grant was based on the premise that such a large investment demands a proper synthesis effort so that the full potential of these experiments are realized through data analysis and modeling. The goal of the this grant was to archive legacy data from two major elevated carbon dioxide experiments in DOE databases, and to engage in synthesis activities using these data. Both goals were met. All datasets deemed a high priority for data synthesis and modeling were prepared for archiving and analysis. Many of these datasets were deposited in DOE’s CDIAC, while others are being held at the Oak Ridge National Lab and the Smithsonian Institution until they can be received by DOE’s new ESS-DIVE system at Berkeley Lab. Most of the effort was invested in researching and re-constituting high-quality data sets from a 30-year elevated CO 2 experiment. Using these data, the grant produced products that are already benefiting climate change science, including the publication of new coastal wetland allometry equations based on 9,771 observations, public posting of dozens of datasets, metadata and supporting codes from long-term experiments at the Global Change Research Wetland, and publication of two synthetic data papers on scrub oak forest responses to elevated CO 2 . In addition, three papers are in review or nearing submission reporting unexpected long-term patterns in ecosystem responses to elevated CO 2 and nitrogen in a coastal wetland.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2018

Control of Reactivity in Nanoporous Metal/Ionic Liquid Composite Catalysts

In this program, we explored a new concept in nanostructured heterogeneous catalysis design – the nanoporous metal/ionic liquid (IL) composite. Over the course of this entire program from inception, we produced sixteen publications [DOE1-DOE16]. The idea behind this concept was to tailor the chemical environment within and near the pores of a nanoporous high surface area metal electrocatalyst in order to enhance the aggregate composite activity and selectivity. Most electrocatalyst design focuses upon lowering the activation barrier for a particular synthesis reaction. While we also try to minimize this quantity, one should also recognize that significant catalytic enhancements can be made by biasing the reaction to completion via control of the environment in which the reaction occurs. Specific ideas we explored in this program included (a) chemically biasing mass transport of reactants to the catalyst surface and products away from it, and (b) corralling of reactants and products to spatially separate them and reduce side reactions. We made a particular focus on electrocatalysis under kinetically limited conditions, and in which the catalyst is a nanoporous metal and the biasing environment is an ionic liquid impregnating the pores.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

Selective Catalytic Reduction of NO by NH 3 with WO 3 -TiO 2 Catalysts: Influence of Catalyst Synthesis Method

A series of supported WO 3 /TiO 2 catalysts was prepared by a new synthesis procedure involving co-precipitation of an aqueous TiO(OH) 2 and (NH 4 ) 10 W 12 O 41 *5H 2 O slurry under controlled pH conditions. The morphological properties, molecular structures, surface acidity and surface chemistry of the supported WO 3 /TiO 2 catalysts were determined with BET, in situ Raman, in situ IR and temperature-programmed surface reaction (TPSR) spectroscopy, respectively. Isotopic 18 O- 16 O exchange demonstrated that tungsten oxide was exclusively present as surface WO x species on the TiO 2 support with mono-oxo W=O coordination. In contrast to previous studies employing impregnation synthesis that found only surface one mono-oxo O=WO 4 site on TiO 2 , the co-precipitation procedure resulted in the formation of two distinct surface WO x species: mono-oxo O=WO 4 (~1010-1017 cm -1 ) on low defect density patches of TiO 2 and a second mono-oxo O=WO 4 (~983-986 cm -1 ) on high defect density patches of TiO 2 . The concentration of the second WO x surface species increases as a function of solution pH. Both surface WOx sites, however, exhibited the same NO/NH 3 SCR reactivity. The co-precipitated WO 3 -TiO 2 catalysts synthesized in alkaline solutions exhibited enhanced performance for the NO/NH 3 SCR reaction that is ascribed to the greater number of surface defects on the resulting TiO2 support. For the co-precipitated catalyst prepared at pH10, surface NH 4 + species on Br nsted acid sites were found to be more reactive than surface NH 3 * species on Lewis acid sites for SCR of NO with NH 3 .

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2014

CO2-Binding Organic Liquids Gas Capture with Polarity-Swing-Assisted Regeneration Full Technology Feasibility Study B1 - Solvent-based Systems

PNNL, Fluor Corporation and Queens University (Kingston, ON) successfully completed a three year comprehensive study of the CO2BOL water-lean solvent platform with Polarity Swing Assisted Regeneration (PSAR). This study encompassed solvent synthesis, characterization, environmental toxicology, physical, thermodynamic and kinetic property measurements, Aspen Plus™ modeling and bench-scale testing of a candidate CO2BOL solvent molecule. Key Program Findings The key program findings are summarized as follows: • PSAR favorably reduced stripper duties and reboiler temperatures with little/no impact to absorption column • >90% CO2 capture was achievable at reasonable liquid-gas ratios in the absorber • High rich solvent viscosities (up to 600 cP) were successfully demonstrated in the bench-scale system. However, the projected impacts of high viscosity to capital cost and operational limits compromised the other levelized cost of electricity benefits. • Low thermal conductivity of organics significantly increased the required cross exchanger surface area, and potentially other heat exchange surfaces. • CO2BOL had low evaporative losses during bench-scale testing • There was no evidence of foaming during bench scale testing • Current CO2BOL formulation costs project to be $35/kg • Ecotoxicity (Water Daphnia) was comparable between CO2BOL and MEA (169.47 versus 103.63 mg/L) • Full dehydration of the flue gas was determined to not be economically feasible. However, modest refrigeration (13 MW for the 550 MW reference system) was determined to be potentially economically feasible, and still produce a water-lean condition for the CO2BOLs (5 wt% steady-state water loading). • CO2BOLs testing with 5 wt% water loading did not compromise anhydrous performance behavior, and showed actual enhancement of CO2 capture performance. • Mass transfer of CO2BOLs was not greatly impeded by viscosity • Facile separation of antisolvent from lean CO2BOL was demonstrated on the bench cart • No measurable solvent degradation was observed over 4 months of testing – even with 5 wt% water present

Heldebrant, David J↗
NASA NTRS1991

Propulsion stability codes for liquid propellant propulsion systems developed for use on a PC computer

Research into component modeling and system synthesis leading to the analysis of the major types of propulsion system instabilities and the characterization of various components characteristics are presented. Last year, several programs designed to run on a PC were developed for Marshall Space Flight Center. These codes covered the low, intermediate, and high frequency modes of oscillation of a liquid rocket propulsion system. No graphics were built into these programs and only simple piping layouts were supported. This year's effort was to add run time graphics to the low and intermediate frequency codes, allow new types of piping elements (accumulators, pumps, and split pipes) in the low frequency code, and develop a new code for the PC to generate Nyquist plots.

Doane, George B., III↗
NASA NTRS1991

Computer-aided system design

A technique has been developed for combining features of a systems architecture design and assessment tool and a software development tool. This technique reduces simulation development time and expands simulation detail. The Architecture Design and Assessment System (ADAS), developed at the Research Triangle Institute, is a set of computer-assisted engineering tools for the design and analysis of computer systems. The ADAS system is based on directed graph concepts and supports the synthesis and analysis of software algorithms mapped to candidate hardware implementations. Greater simulation detail is provided by the ADAS functional simulator. With the functional simulator, programs written in either Ada or C can be used to provide a detailed description of graph nodes. A Computer-Aided Software Engineering tool developed at the Charles Stark Draper Laboratory (CSDL CASE) automatically generates Ada or C code from engineering block diagram specifications designed with an interactive graphical interface. A technique to use the tools together has been developed, which further automates the design process.

Walker, Carrie K.↗
NASA NTRS2003

Large-Scale Production of Carbon Nanotubes Using the Jefferson Lab Free Electron Laser

We report on our interdisciplinary program to use the Free Electron Laser (FEL) at the Thomas Jefferson National Accelerator Facility (J-Lab) for high-volume pulsed laser vaporization synthesis of carbon nanotubes. Based in part on the funding of from this project, a novel nanotube production system was designed, tested, and patented. Using this new system nanotube production rates over 100 times faster than conventional laser systems were achieved. Analysis of the material produced shows that it is of as high a quality as the standard laser-based materials.

Holloway, Brian C.↗
NASA NTRS2011

Getting the GeoSTAR Instrument Concept Ready for a Space Mission

The Geostationary Synthetic Thinned Array Radiometer - GeoSTAR - is a microwave sounder intended for geostationary satellites. First proposed for the EO-3 New Millennium mission in 1999, the technology has since been developed under the Instrument Incubator Program. Under IIP-03 a proof-of-concept demonstrator operating in the temperature sounding 50 GHz band was developed to show that the aperture synthesis concept results in a realizable, stable and accurate imaging-sounding radiometer. Some of the most challenging technology, such as miniature low-power 183- GHz receivers used for water vapor sounding, was developed under IIP-07. The first such receiver has recently been adapted for use in the High Altitude MMIC Sounding Radiometer (HAMSR), which was previously developed under IIP-98. This receiver represents a new state of the art and outperforms the previous benchmark by an order of magnitude in radiometric sensitivity. It was first used in the GRIP hurricane field campaign in 2010, where HAMSR became the first microwave sounder to fly on the Global Hawk UAV. Now, under IIP-10, we will develop flight-like subsystems and a brassboard testing system, which will facilitate rapid implementation of a space mission. GeoSTAR is the baseline payload for the Precipitation and All-weather Temperature and Humidity (PATH) mission - one of NASA's 15 "decadal-survey" missions. Although PATH is currently in the third tier of those missions, the IIP efforts have advanced the required technology to a point where a space mission can be initiated in a time frame commensurate with second-tier missions. An even earlier Venture mission is also being considered.

millimeter-wave↗
DOE OSTI2017

Biofuels Refining Engineering

The goal of this project is the development of novel catalysts and knowledge of reaction pathways and mechanisms for conversion of biomass-based compounds to fuels that are compatible with oil-based fuels and with acceptable or superior fuel properties. The research scope included both catalysts to convert lignocellulosic biomass-based molecules (from pyrolysis) and vegetable oil-based molecules (i.e., triglycerides and fatty acid methyl esters). This project comprised five technical tasks. Each task is briefly introduced below, and major technical accomplishments summarized. Technical accomplishments were described in greater detail in the quarterly progress reports, and in even more detail in the >50 publications acknowledging this DoE project funding (list of publications and presentations included at the end of this report). The results of this research added greatly to the knowledge base necessary for upgrading of pyrolysis oil to hydrocarbon fuels and chemicals, and for conversion of vegetable oils to fungible diesel fuel. Numerous new catalysts and catalytic reaction systems were developed for upgrading particular compounds or compound families found in the biomass-based pyrolysis oils and vegetable oils. Methods to mitigate catalyst deactivation were investigated, including novel reaction/separation systems. Performance and emission characteristics of biofuels in flames and engines were measured. Importantly, the knowledge developed from this project became the basis for a subsequent collaborative proposal led by our research group, involving researchers from the University of Wisconsin, the University of Pittsburg, and the Idaho National Lab, for the DoE Carbon, Hydrogen and Separations Efficiency (CHASE) program, which was subsequently funded (one of only four projects awarded in the CHASE program). The CHASE project examined novel catalytic processes for lignocellulosic biomass conversion as well as technoeconomic analyses for process options for maximum carbon capture and hydrogen efficiency. Our research approach combined catalyst synthesis, measurements of catalyst activity and selectivity in different reactor systems and conditions, and detailed catalyst characterization to develop fundamental understanding of reaction pathways and the capability to predict product distributions. Nearly all of the candidate catalysts were prepared in-house via standard techniques such as impregnation, co-impregnation, or chemical vapor deposition. Supports were usually purchased, but in some cases coprecipitation was used to simultaneously create the support and active component, which can be advantageous for strong active component-support interactions and for achieving high active component dispersion. In-house synthesis also allowed for studies of the effects on catalyst activity and selectivity of such factors as support porosity, calcination temperature, and reduction/activation conditions. Depending on the physical characteristics of the molecule, catalyst activity measurements were carried out in tubular flow reactors (for vapor phase reactions) or stirred tank reactors (for liquid phase reactions) over a wide range of pressures and temperatures. Reactant and product concentrations were measured using gas chromatography (both on-line and off-line, with TCD, FID, and/or mass spectrometric detection). For promising catalysts, detailed physicochemical characterization was carried out using FTIR, Raman, XPS, and XRD spectroscopies (all available in our laboratories) and TEM spectroscopy (available at OU). Additional methods included temperature programmed techniques (TPD, TPO) and surface area measurements by nitrogen adsorption techniques.

01 COAL, LIGNITE, AND PEAT↗
DOE OSTI2021

Synthesis of a planar, multicomponent catalytic surface of Na 2 CO 3 /MnO

Here, O 2 adsorption on MnO(100) precovered with sodium (Na) multilayers was investigated by X-ray photoelectron spectroscopy (XPS) and temperature programmed desorption (TPD). Deposition of Na multilayers leads to a first monolayer of oxidic Na followed by metallic Na island growth. XPS results for the oxidation of the metallic Na islands indicate an incomplete oxidation of Na at 125 K. Oxidation at 350 K completely oxidizes the metallic islands producing a mixture of Na 2 O and Na 2 O 2 . Thermal evolution of the oxidation products was examined. After oxidation at 350 K and flashing to 750 K, Na 2 O and Na 2 O 2 are the primary oxides on MnO(100). After flashing to 850 K, a solid state reaction of Na 2 O 2 /Na 2 O and the MnO(100) substrate forms a NaMnO 2 -like surface compound which decomposes above 850 K. Oxygen exchange between CO 2 and Na oxides is observed. The strong interaction between CO 2 and Na oxide islands forms Na 2 CO 3 on MnO(100). Heating the Na 2 CO 3 covered MnO(100) surface to 600 K for 10 min drives oxidic Na in the first monolayer into the MnO subsurface, and produces a surface exposing islands of Na 2 CO 3 on MnO(100).

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1989

Multiprocessor architecture: Synthesis and evaluation

The goal is to remove the influence of the choice of algorithm used for a particular application and to remove the effects of the high-level language and the efficiency of the program. The study concentrates on only those characteristics of the structure of the architecture. The structure of the architecture is defined to include those parameters that distinguish an architectural design at the diagram level. For example, the interconnection network plays an integral part in such a description while the capabilities of the individual processing elements, while crucial to the execution of the program, are not represented in the diagram.

Standley, Hilda M.↗
DOE OSTI2020

A Gene Cluster That Encodes Histone Deacetylase Inhibitors Contributes to Bacterial Persistence and Antibiotic Tolerance in Burkholderia thailandensis

Persister cells are genetically identical variants in a bacterial population that have phenotypically modified their physiology to survive environmental stress. In bacterial pathogens, persisters are able to survive antibiotic treatment and reinfect patients in a frustrating cycle of chronic infection. To better define core persistence mechanisms for therapeutics development, we performed transcriptomics analyses of Burkholderia thailandensis populations enriched for persisters via three methods: flow sorting for low proton motive force, meropenem treatment, and culture aging. Although the three persister-enriched populations generally displayed divergent gene expression profiles that reflect the multimechanistic nature of stress adaptations, there were several common gene pathways activated in two or all three populations. These include polyketide and nonribosomal peptide synthesis, Clp proteases, mobile elements, enzymes involved in lipid metabolism, and ATP binding cassette (ABC) transporter systems. In particular, identification of genes that encode polyketide synthases (PKSs) and fatty acid catabolism factors indicates that generation of secondary metabolites, natural products, and complex lipids could be part of the metabolic program that governs the persistence state. We also found that loss-of-function mutations in the PKS-encoding gene locus BTH_I2366, which plays a role in biosynthesis of histone deacetylase (HDAC) inhibitors, resulted in increased sensitivity to antibiotics targeting DNA replication. Furthermore, treatment of multiple bacterial pathogens with a fatty acid synthesis inhibitor, CP-640186, potentiated the efficacy of meropenem against the persister populations. Altogether, our results suggest that bacterial persisters may exhibit an outwardly dormant physiology but maintain active metabolic processes that are required to maintain persistence.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2020

Mediated Fuel Cells: Soluble Redox Mediators and their Applications to Electrochemical Reduction of O2 and Oxidation of H2, Alcohols, Biomass, and Complex Fuels

Mediated fuel cells are electrochemical devices that produce power in a manner similar to that of conventional proton exchange membrane fuel cells (PEMFCs). They differ from PEMFCs in their use of redox mediators dissolved in liquid electrolyte to conduct oxidation of the fuel or reduction of the oxidant, typically O2, in bulk solution. The mediators transport electrons (and often protons) between the electrode and the catalysts or chemical reagents in solution. This strategy can help overcome many of the challenges associated with conventional fuel cells, including managing complex multi-phase reactions (as in O2 reduction) or the use of challenging or heterogeneous fuels, such as hydrocarbons, polyols and biomass. Mediators are also commonly used in enzymatic fuel cells, where direct electron transfer from the electrode to the enzymatic active site can be slow. This review provides a comprehensive survey of historical and recent mediated fuel cell efforts, including applications using chemical and enzymatic catalysts. Our research on in this field has been exploring a number of different topics and has been supported different funding sources: the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences (molecular mediators for catalytic oxygen reduction); the Great Lakes Bioenergy Research Center, DOE Office of Science DE-SC0018409 (research on biomass-based fuels; U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Catalysis Program, DE-FG02-05ER15690 (copper-catalyzed oxidation reactions); and the NIH NIGMS, R01 GM100143 and R35 GM134929 (use of molecular mediators for organic chemical synthesis).

Anson, Colin W.↗
DOE OSTI2023

Architecture-Preserving Provable Repair of Deep Neural Networks

Deep neural networks (DNNs) are becoming increasingly important components of software, and are considered the state-of-the-art solution for a number of problems, such as image recognition. However, DNNs are far from infallible, and incorrect behavior of DNNs can have disastrous real-world consequences. This paper addresses the problem of architecture-preserving V-polytope provable repair of DNNs. A V-polytope defines a convex bounded polytope using its vertex representation. V-polytope provable repair guarantees that the repaired DNN satisfies the given specification on the infinite set of points in the given V-polytope. An architecture-preserving repair only modifies the parameters of the DNN, without modifying its architecture. The repair has the flexibility to modify multiple layers of the DNN, and runs in polynomial time. It supports DNNs with activation functions that have some linear pieces, as well as fully-connected, convolutional, pooling and residual layers. To the best our knowledge, this is the first provable repair approach that has all of these features. We implement our approach in a tool called APRNN. Using MNIST, ImageNet, and ACAS Xu DNNs, we show that it has better efficiency, scalability, and generalization compared to PRDNN and REASSURE, prior provable repair methods that are not architecture preserving.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS1982

The 1981 NASA/ASEE Summer Faculty Fellowship Program: Research reports

Research reports related to spacecraft industry technological advances, requirements, and applications were considered. Some of the topic areas addressed were: (1) Fabrication, evaluation, and use of high performance composites and ceramics, (2) antenna designs, (3) electronics and microcomputer applications and mathematical modeling and programming techniques, (4) design, fabrication, and failure detection methods for structural materials, components, and total systems, and (5) chemical studies of bindary organic mixtures and polymer synthesis. Space environment parameters were also discussed.

Karr, G. R.↗
NASA NTRS1982

Eigenspace techniques for active flutter suppression

Mathematical models to be used in the control system design were developed. A computer program, which takes aerodynamic and structural data for the ARW-2 aircraft and converts these data into state space models suitable for use in modern control synthesis procedures, was developed. Reduced order models of inboard and outboard control surface actuator dynamics and a second order vertical wind gust model were developed. An analysis of the rigid body motion of the ARW-2 was conducted. The deletion of the aerodynamic lag states in the rigid body modes resulted in more accurate values for the eigenvalues associated with the plunge and pitch modes than were obtainable if the lag states were retained.

Garrard, W. L.↗