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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 361 records · Page 20

Metastable doubly threaded [3]rotaxanes with a large macrocycle

Ring size is a critically important parameter in many interlocked molecules as it directly impacts many of the unique molecular motions that they exhibit. Reported herein are studies using one of the largest macrocycles reported to date to synthesize doubly threaded [3]rotaxanes. A large ditopic 46 atom macrocycle containing two 2,6-bis(N-alkyl-benzimidazolyl)pyridine ligands has been used to synthesize several metastable doubly threaded [3]rotaxanes in high yield (65–75% isolated) via metal templating. Macrocycle and linear thread components were synthesized and self-assembled upon addition of iron(II) ions to form the doubly threaded pseudo[3]rotaxanes that could be subsequently stoppered using azide–alkyne cycloaddition chemistry. Following demetallation with base, these doubly threaded [3]rotaxanes were fully characterized utilizing a variety of NMR spectroscopy, mass spectrometry, size-exclusion chromatography, and all-atom simulation techniques. Critical to the success of accessing a metastable [3]rotaxane with such a large macrocycle was the nature of the stopper group employed. By varying the size of the stopper group it was possible to access metastable [3]rotaxanes with stabilities in deuterated chloroform ranging from a half-life of <1 minute to ca. 6 months at room temperature potentially opening the door to interlocked materials with controllable degradation rates.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

SUNDIALS time integrators for exascale applications with many independent systems of ordinary differential equations

Many complex systems can be accurately modeled as a set of coupled time-dependent partial differential equations (PDEs). However, solving such equations can be prohibitively expensive, easily taxing the world’s largest supercomputers. One pragmatic strategy for attacking such problems is to split the PDEs into components that can more easily be solved in isolation. This operator splitting approach is used ubiquitously across scientific domains, and in many cases leads to a set of ordinary differential equations (ODEs) that need to be solved as part of a larger “outer-loop” time-stepping approach. The SUNDIALS library provides a plethora of robust time integration algorithms for solving ODEs, and the U.S. Department of Energy Exascale Computing Project (ECP) has supported its extension to applications on exascale-capable computing hardware. In this paper, we highlight some SUNDIALS capabilities and its deployment in combustion and cosmology application codes (Pele and Nyx, respectively) where operator splitting gives rise to numerous, small ODE systems that must be solved concurrently.

97 MATHEMATICS AND COMPUTING↗

Extended hopane derivatives in sediments - Identification by H-1 NMR

Sedimentary C32 hopanoic acid, one of the most abundant in nature and of probable bacterial origin, has been isolated for the first time as a single component and characterized by H-1 NMR. The 17 alpha H, 21 beta H configuration of the C31 alkane has been similarly confirmed.

Taylor, J.↗

Optimal decentralized feedback control for a truss structure

One approach to the decentralized control of large flexible space structures involves the design of controllers for the substructures of large systems and their subsequent application to the entire coupled system. This approach is presently developed for the case of active vibration damping on an experimental large struss structure. The isolated boundary loading method is used to define component models by FEM; component controllers are designed using an interlocking control concept which minimizes the motion of the boundary nodes, thereby reducing the exchange of mechanical disturbances among components.

Cagle, A.↗

Improved Dual-Polarized Microstrip Antenna

Dual-polarized microstrip antenna features microstrip transmission-line feeds arranged in such configuration that cross-polarized components of radiation relatively low and degree of isolation between feed ports relatively high. V and H feed ports offset from midpoints of feed lines to obtain required opposite phases at feed-point connections to microstrip patches. Two independent beams of same frequency with electric fields polarized orthogonally to each other transmitted or received via antenna. Improved design saves space.

Huang, John↗

Thermal protection systems for space transportation vehicles

The topics addressed are history of reusable external insulation (RSI), and examples of shuttle RSI development challenges, which includes: (1) manufacturing of raw materials, such as fibers, coating components; (2) design of tile planform size, strain isolation, and gap heating; (3) insulation, such as bonding, bond verification, tolerances, and quality control; and (4) operation, such as durability, and water proofing.

Goldstein, Howard E.↗

Planetary Atmosphere Dynamics and Radiative Transfer

This research program has dealt with two projects in the field of planetary atmosphere dynamics and radiative energy transfer, one theoretical and one experimental. The first project, in radiative energy transfer, incorporated the capability to isolate and quantify the contribution of individual atmospheric components to the Venus radiative balance and thermal structure to greatly improve the current understanding of the radiative processes occurring within the Venus atmosphere. This is possible by varying the mixing ratios of each gas species, and the location, number density and aerosol size distributions of the clouds. This project was a continuation of the work initiated under a 1992 University Consortium Agreement. Under the just completed grant, work has continued on the use of a convolution-based algorithm that provided the capability to calculate the k coefficients of a gas mixture at different temperatures, pressures and spectral intervals from the separate k-distributions of the individual gas species. The second primary goal of this research dealt with the Doppler wind retrieval for the Successful Galileo Jupiter probe mission in December, 1995. In anticipation of the arrival of Galileo at Jupiter, software development continued to read the radioscience and probe/orbiter trajectory data provided by the Galileo project and required for Jupiter zonal wind measurements. Sample experiment radioscience data records and probe/orbiter trajectory data files provided by the Galileo Radioscience and Navigation teams at the Jet Propulsion Laboratory, respectively, were used for the first phase of the software development. The software to read the necessary data records was completed in 1995. The procedure by which the wind retrieval takes place begins with initial consistency checks of the raw data, preliminary data reductions, wind recoveries, iterative reconstruction of the probe descent profile, and refined wind recoveries. At each stage of the wind recovery consistency is checked and maintained between the orbiter navigational data, the radioscience data, and the probe descent profile derived by the Atmospheric Instrument Team. Preliminary results show that the zonal winds at Jupiter increase with depth to approximately 150 m/s.

Atkinson, David H.↗

Molecular chaperone properties of the high molecular weight aggregate from aged lens

The high molecular weight aggregate (HMWA) fraction was isolated from the water soluble proteins of aged bovine lenses. Its composition and ability to inhibit heat-induced denaturation and aggregation were compared with the lower molecular weight, oligomeric fraction of alpha isolated from the same lens. Although the major components of both fractions were the alpha-A and alpha-B chains, the HMWA fraction possessed a decreased ability to protect other proteins against heat-induced denaturation and aggregation. Immunoelectron microscopy of both fractions demonstrated that alpha particles from the HMWA fraction contained increased amounts of beta and gamma crystallins, bound to a central region of the supramolecular complex. Together, these results demonstrate that alpha crystallins found in the HMWA fraction possess a decreased ability to protect against heat-induced denaturation and aggregation, and suggest that at least part of this decrease could be due to the increased presence of beta and gamma crystallins complexed to the putative chaperone receptor site of the alpha particles.

NASA Discipline Developmental Biology↗

Advanced Diagnostic System on Earth Observing One

In this infusion experiment, the Livingstone 2 (L2) model-based diagnosis engine, developed by the Computational Sciences division at NASA Ames Research Center, has been uploaded to the Earth Observing One (EO-1) satellite. L2 is integrated with the Autonomous Sciencecraft Experiment (ASE) which provides an on-board planning capability and a software bridge to the spacecraft's 1773 data bus. Using a model of the spacecraft subsystems, L2 predicts nominal state transitions initiated by control commands, monitors the spacecraft sensors, and, in the case of failure, isolates the fault based on the discrepant observations. Fault detection and isolation is done by determining a set of component modes, including most likely failures, which satisfy the current observations. All mode transitions and diagnoses are telemetered to the ground for analysis. The initial L2 model is scoped to EO-1's imaging instruments and solid state recorder. Diagnostic scenarios for EO-1's nominal imaging timeline are demonstrated by injecting simulated faults on-board the spacecraft. The solid state recorder stores the science images and also hosts: the experiment software. The main objective of the experiment is to mature the L2 technology to Technology Readiness Level (TRL) 7. Experiment results are presented, as well as a discussion of the challenging technical issues encountered. Future extensions may explore coordination with the planner, and model-based ground operations.

Hayden, Sandra C.↗

Post-Test Inspection of NASA's Evolutionary Xenon Thruster Long-Duration Test Hardware: Discharge Chamber

The NEXT Long-Duration Test is part of a comprehensive thruster service life assessment intended to demonstrate overall throughput capability, validate service life models, quantify wear rates as a function of time and operating condition, and identify any unknown life-limiting mechanisms. The test was voluntarily terminated in February 2014 after demonstrating 51,184 hours of high-voltage operation, 918 kg of propellant throughput, and 35.5 MN-s of total impulse. The post-test inspection of the thruster hardware began shortly afterwards with a combination of non-destructive and destructive analysis techniques, and is presently nearing completion. This paper presents relevant results of the post-test inspection for the discharge chamber as well as other miscellaneous components such as the high-voltage propellant isolators and electrical cabling. Comparison of magnetic field measurements taken during pretest and post-test inspections indicate that the field strength did not degrade, consistent with performance data obtained during the test. Inspection of discharge chamber mesh samples show a deposition coating primarily composed of grid material that is approximately 15 micrometers in thickness. This thickness is well within the retention capability of the mesh and is therefore not expected to present any issues. Approximately 3.1 grams of deposition flakes were found at the bottom of the discharge chamber, composed primarily of grid material and carbon. Calculated size histograms of these flakes indicate that 99% have a maximum dimension of 200 micrometers or smaller, which is significantly less than the ion optics grid gap. Larger flakes that are capable of causing a grid-to-grid short will be analyzed to determine if their formation will occur in flight or is a facility effect. The high-voltage propellant isolators as well as numerous other electrical insulators were inspected and no evidence of arcing or any other issues were found.

Electric Propulsion↗

Post-test Inspection of NASA’s Evolutionary Xenon Thruster Long-Duration Test Hardware: Discharge Chamber

The NEXT Long-Duration Test is part of a comprehensive thruster service life assessment intended to demonstrate overall throughput capability, validate service life models, quantify wear rates as a function of time and operating condition, and identify any unknown life-limiting mechanisms. The test was voluntarily terminated in February 2014after demonstrating 51,184 hours of high-voltage operation, 918 kg of propellant throughput, and 35.5 MN-s of total impulse. The post-test inspection of the thruster hardware began shortly afterwards with a combination of non-destructive and destructive analysis techniques, and is presently nearing completion. This paper presents relevant results of the post-test inspection for the discharge chamber as well as other miscellaneous components such as the high-voltage propellant isolators and electrical cabling. Comparison of magnetic field measurements taken during pretest and post-test inspections indicate that the field strength did not degrade, consistent with performance data obtained during the test. Inspection of discharge chamber mesh samples show a deposition coating primarily composed of grid material that is approximately 15 μm in thickness. This thickness is well within the retention capability of the mesh and is therefore not expected to present any issues. Approximately 3.1 grams of deposition flakes were found at the bottom of the discharge chamber, composed primarily of grid material and carbon. Calculated size histograms of these flakes indicate that 99% have a maximum dimension of 200 μm or smaller, which is significantly less than the ion optics grid gap. Larger flakes that are capable of causing a grid-to-grid short will be analyzed to determine if their formation will occur in flight or is a facility effect. The high-voltage propellant isolators as well as numerous other electrical insulators were inspected and no evidence of arcing or any other issues were found.

Rohit Shastry↗

A Comparative Analysis of Occupant Response Between Component and Full Vehicle Tests of Fokker F28 Aircraft Hardware

In 2019, the National Aeronautics and Space Administration (NASA) Langley Research Center (LaRC) conducted a full-scale crash test of a Fokker F28 MK1000 aircraft. This test concluded a multi-year research effort in which two component fuselage sections of a matching Fokker F28 aircraft were previously tested under similar vertical impact conditions. Due to facility and cost constraints of full-scale testing, aircraft are typically evaluated through component level tests (i.e. vertical drops of fuselage subsections or isolated seat tests). Although more practical, these tests are limited in their ability fully replicate the complex multi-axis loading environment induced on the occupants during a full-aircraft crash event. Because of this, there is risk that component level testing does not provide a complete assessment of vehicle crashworthiness. Comparative analysis between full-scale and component level testing of the Fokker F28 aircraft provides an excellent opportunity to evaluate differences in crashworthiness prediction made between these levels of test fidelity. In this study, Anthropomorphic Test Device (ATD, a.k.a crash test dummies) responses measured during the Fokker full scale impact test were compared to those measured in the component fuselage section drops. A variety of ATD configurations (5th, 50th, 95th) and positions (upright, braced) were tested in both the full-scale and component tests. ATD injury metric response comparisons were made across these ATD variations in addition to comparisons made with respect to ATD location within the vehicle. Results found the addition of horizontal impact velocity, achieved in the full-scale testing, along with aircraft structural effects altered ATD based crashworthiness assessment of the vehicle.

Crashworthiness↗

Multiphysics Time-Integration for Turbulent Combustion at the Exascale

Turbulent reacting flow systems are often modeled with coupled time-dependent partial differential equations (PDEs). Solving such equations can easily tax the world's largest supercomputers. One pragmatic strategy for attacking such problems is to split the PDEs into components that can more easily be solved in isolation. This generic operator-splitting strategy leads to a set of ordinary differential equations (ODEs) that need to be solved as part of an "outer-loop" time-stepping approach. In many combustion applications, the ODEs to be solved can be very stiff, exhibiting timescales that span many orders of magnitude. The SUNDIALS library provides a plethora of robust time integration algorithms for solving these ODEs on exascale-capable computing hardware, yet for many complex applications (such multicomponent fuels or emissions predictions), the chemical models remain too complex to solve using reasonable resources. The Quasi-Steady State Approximation (QSSA) can be an effective tool for reducing the size and stiffness of the simulations. In this talk, I will discuss the use of the SUDIALS library of ODE solvers together with automatic code generation tools to solve complex turbulent reacting flow problems using QSSA models.

chemistry↗

Rejuvenating dead lithium supply in lithium metal anodes by iodine redox

Inactive lithium (more frequently called dead lithium) in the forms of solid-electrolyte interphase and electrically isolated metallic lithium is principally responsible for the performance decay commonly observed in lithium metal batteries. A fundamental solution of recovering dead lithium is urgently needed to stabilize lithium metal batteries. In this paper, we quantify the solid-electrolyte interphase components, and determine their relation with the formation of electrically isolated dead lithium metal. We present a lithium restoration method based on a series of iodine redox reactions mainly involving I 3 - /I - . Using a biochar capsule host for iodine, we show that the I 3 - /I - redox takes place spontaneously, effectively rejuvenating dead lithium to compensate the lithium loss. Through this design, a full-cell using a very limited lithium metal anode exhibits an excellent lifespan of 1,000 cycles with a high Coulombic efficiency of 99.9%. We also demonstrate the design with a commercial cathode in pouch cells. Cycling lithium batteries often results in inactive lithium that no longer participates in redox reactions, leading to performance deterioration. Here the authors use an iodic species to react with inactive lithium, bringing it back to life and thus making batteries last longer.

25 ENERGY STORAGE↗

Status of the LCLS-II Cryogenic Distribution System

The LINAC Coherent Light Source II (LCLS-II) located at SLAC National Accelerator Laboratory (SLAC) in Menlo Park, CA, is a U.S. Department of Energy project tasked to design and build a world-class x-ray free-electron laser facility for scientific research. The Linac has superconducting radio frequency cryomodules that are connected to the cryogenic plant by the Cryogenic Distribution System (CDS), which consists of distribution boxes with heat exchangers and reliefs, feed caps, end caps, and surface, vertical, and bypass transfer lines. The CDS components were designed and built to specification by industry. The components have been delivered and their installation at SLAC will be discussed. The as-built relief system design will be presented, showing minimization of relief inlet pressure drops while meeting capacity requirements. The relieving flow pressure drops along the lengths of the CDS to centrally located reliefs at the distribution box were analysed to satisfy Pressure Vessel and Process Piping Code criteria to ensure relief performance. The sub-atmospheric 2 K circuit relieving approach will be discussed, which includes a three-way diverter isolation valve suitable for sub-atmospheric service. The component anchoring load design approach and installation into concrete floor will be discussed. This addresses loading, including seismic loading, along the component’s load path to floor anchoring system.

43 PARTICLE ACCELERATORS↗

Defects in electro-optically active polymer solids

There is considerable current interest in the application of organic and polymeric materials for electronic and photonic devices. The rapid, non-linear optical (NLO) response of these materials makes them attractive candidates for waveguides, interferometers, and frequency doublers. In order to realize the full potential of these systems, it is necessary to develop processing schemes which can fabricate these molecules into ordered arrangements. There is enormous potential for introducing well-defined, local variations in microstructure to control the photonic properties of organic materials by rational 'defect engineering.' This effort may eventually become as technologically important as the manipulation of the electronic structure of solid-state silicon based devices is at present. The success of this endeavor will require complimentary efforts in the synthesis, processing, and characterization of new materials. Detailed information about local microstructure will be necessary to understand the influence of symmetry breaking of the solid phases near point, line, and planar defects. In metallic and inorganic polycrystalline materials, defects play an important role in modifying macroscopic properties. To understand the influence of particular defects on the properties of materials, it has proven useful to isolate the defect by creating bicrystals between two-component single crystals. In this way the geometry of a grain boundary defect and its effect on macroscopic properties can be determined unambiguously. In crystalline polymers it would be valuable to establish a similar depth of understanding about the relationship between defect structure and macroscopic properties. Conventionally processed crystalline polymers have small crystallites (10-20 nm), which implies a large defect density in the solid state. Although this means that defects may play an important or even dominant role in crystalline or liquid crystalline polymer systems, it also makes it difficult to isolate the effect of a particular boundary on a macroscopically observed property. However, the development of solid-state and thin-film polymerization mechanisms have facilitated the synthesis of highly organized and ordered polymers. These systems provide a unique opportunity to isolate and investigate in detail the structure of covalently bonded solids near defects and the effect of these defects on the properties of the material. The study of defects in solid polymers has been the subject of a recent review (Martin, 1993).

Martin, David C.↗

The ethylene response pathway in Arabidopsis

The simple gas ethylene influences a diverse array of plant growth and developmental processes including germination, senescence, cell elongation, and fruit ripening. This review focuses on recent molecular genetic studies, principally in Arabidopsis, in which components of the ethylene response pathway have been identified. The isolation and characterization of two of these genes has revealed that ethylene sensing involves a protein kinase cascade. One of these genes encodes a protein with similarity to the ubiquitous Raf family of Ser/Thr protein kinases. A second gene shows similarity to the prokaryotic two-component histidine kinases and most likely encodes an ethylene receptor. Additional elements involved in ethylene signaling have only been identified genetically. The characterization of these genes and mutants will be discussed.

Non-NASA Center↗