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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 775 records · Page 43

Mechanism for rapid growth of organic–inorganic halide perovskite crystals

Optoelectronic devices based on hybrid halide perovskites have shown remarkable progress to high performance. However, despite their apparent success, there remain many open questions about their intrinsic properties. Single crystals are often seen as the ideal platform for understanding the limits of crystalline materials, and recent reports of rapid, high-temperature crystallization of single crystals should enable a variety of studies. Here we explore the mechanism of this crystallization and find that it is due to reversible changes in the solution where breaking up of colloids, and a change in the solvent strength, leads to supersaturation and subsequent crystallization. Here, we use this knowledge to demonstrate a broader range of processing parameters and show that these can lead to improved crystal quality. Lastly, our findings are therefore of central importance to enable the continued advancement of perovskite optoelectronics and to the improved reproducibility through a better understanding of factors influencing and controlling crystallization.

36 MATERIALS SCIENCE↗

Universal diamond edge Raman scale to 0.5 terapascal and implications for the metallization of hydrogen

The recent progress in generating static pressures up to terapascal values opens opportunities for studying novel materials with unusual properties, such as metallization of hydrogen and high-temperature superconductivity. However, an evaluation of pressure above ~0.3 terapascal is a challenge. We report a universal high-pressure scale up to ~0.5 terapascal, which is based on the shift of the Raman edge of stressed diamond anvils correlated with the equation of state of Au and does not require an additional pressure sensor. According to the new scale, the pressure values are substantially lower by 20% at ~0.5 terapascal compared to the extrapolation of the existing scales. We compare the available data of H 2 at the highest static pressures. We show that the onset of the proposed metallization of molecular hydrogen reported by different groups is consistent when corrected with the new scale and can be compared with various theoretical predictions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Blocking like it's hot: a synthetic chemists’ path to high-temperature lanthanide single molecule magnets

Progress in the synthesis, design, and characterisation of single-molecule magnets (SMMs) has expanded dramatically from curiosity driven beginnings to molecules that retain magnetization above the boiling point of liquid nitrogen. This is in no small part due to the increasingly collaborative nature of this research where synthetic targets are guided by theoretical design criteria. This article aims to summarize these efforts and progress from the perspective of a synthetic chemist with a focus on how chemistry can modulate physical properties. Here, a simple overview is presented of lanthanide electronic structure in order to contextualize the synthetic advances that have led to drastic improvements in the performance of lanthanide-based SMMs from the early 2000s to the late 2010s.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Exploring Enhanced Dominant Resource Fairness Using Linear Programming Calculated Weights

Maintaining resource fairness while achieving optimization for various performance metrics such as resource utilization, turnaround time and job latency is a well-known resource scheduling challenge in cloud computing. Despite the significant progress made with the introduction of dominant resource fairness by Ghodsi et al., which ensures major allocation properties such as sharing incentive, strategy-proofness, envy-freeness and Pareto efficiency to be achieved

Yan, Bo [Binghamton University]↗

Using and Developing Novel Data Analytics for Digitalized Microstructures. Draft

The primary goal of this work is to develop and implement analytic methods for quantitative analysis of microstructure. These analytic methods are demonstrated on microstructures generated by the Sandia kinAic Monte Carlo code SPPARKS. This report documents progress to that end as well as incremental work towards larger aspirations of making process-structure-property connections for complex processes such as welding and additive manufacturing.

42 ENGINEERING↗

Mechanisms of Mobility of Grain Boundaries in Tungsten

The objective of this study is to assess the mechanical robustness of tungsten in first-wall applications for tokamaks. These applications unavoidably involve the challenges of high temperature and radiation damage. Here we report progress on determining the mechanisms governing the mobility of tungsten grain boundaries at high temperature, a key property in the process of recrystallization. The determination of mechanisms enables predictive analytic models of grain boundary response to driving forces like the energy stored in the damaged metal lattice that is released as a grain boundary sweeps through it. In prior work we studied tungsten grain boundary properties such as the energies of boundaries with various orientations and misorientations, including energies of grain boundaries whose high-temperature structure differs from the structure at ambient conditions. We have calculated properties associated with the grain boundary mobility including the response of grain boundaries to applied shear stress. We have also developed methods for direct calculation of the motion of curved grain boundaries at high temperature using molecular dynamics. Here we again utilize molecular dynamics simulation of grain boundary motion and go further to analyze how the defect content in a grain boundary evolves as the boundary moves under the action of a driving force.

36 MATERIALS SCIENCE↗

Freezing Processes in Southern Ocean Mixed Phase Clouds (Final Technical Report)

Southern Ocean (SO) low-level clouds remain a challenge for Earth system models to represent accurately. This project utilized DOE ARM observations and the Community Atmosphere Model (CAM) to improve process-level understanding of aerosol-cloud interactions and cloud microphysics for SO mixed-phase clouds. Specifically, our efforts include two main topics: 1) investigate the SO aerosol, cloud condensation nuclei (CCN), and ice nucleating particle (INP) population based on observations and determine predictive skill of simulating SO INPs, and 2) assess the ice formation pathways, including ice nucleation and secondary ice production, in SO mixed phase clouds utilizing a combination of observations and modeling tools. Studies focused on SO aerosol and INP resulted four manuscripts. Ice formation pathways in SO mixed phase clouds were investigated, revealing observed evidence of SIP active across all mixed phase temperatures. However, a key finding of this project is that despite significant progress in predicting SO INPs, the role of INP variability in SO cloud phase, precipitation, and radiative properties remain unknown due to challenges in microphysics parameterizations.

54 ENVIRONMENTAL SCIENCES↗

Angular particle impingement studies of thermoplastic materials at normal incidence

Scanning electron microscope studies were conducted to characterize the erosion resistance of polymethyl methacrylate (PMMA), polycarbonate (PC), polytetrafluorethylene (PTFE), and ultra-high-molecular-weight polyethylene (UHMWPE). Erosion was caused by a jet of angular microparticles of crushed glass at normal incidence. Material built up above the original surface on all of the materials. As erosion progressed, this buildup disappeared. UHMWPE was the most resistant material and PMMA the least. The most favorable properties for high erosion resistance were high values of ultimate elongation, maximum service temperature, and strain energy and a low value of the modulus of elasticity. Erosion-rate-versus-time curves of PC and PTFE exhibited incubation, acceleration, and steady-state periods. PMMA also exhibited a deceleration period, and an incubation period with deposition was observed for UHMWPE.

Rao, P. V.↗

Morphological and physical characteristics of the Virgo Cluster - First results from the Las Campanas photographic survey

Preliminary results are presented of a photographic survey of the Virgo cluster to the faintest convenient limit of the Las Campanas du Pont 2.5 m reflector, performed in order to study the complexity of both the surface and velocity distributions within the central 6 degree radius region. The survey is described and the resulting Catalog is discussed, and the frequency of galaxy types found and listed in the Catalog is described. The physical properties of the dwarfs are summarized, and luminosity functions are given separately for each morphological type. The progressive change of (MBT) faintward along the morphological sequence from Sc I through Sm and Im types is shown, leading to a calibration of the de Vaucouleurs Lambda luminosity index and a determination of its intrinsic dispersion. The preliminary results on the distribution of galaxies of all types in the two principal subclustering regions found are summarized, and the velocity distributions over the face of the 6 degree core are discussed for the various galaxy types.

Sandage, A.↗

Low-frequency magnetic fluctuation spectra in the magnetosheath and plasma depletion layer

Recent observations have delineated several different kinds of enhanced magnetic fluctuation spectra below the proton cyclotron frequency in the terrestrial magnetosheath. A model is presented that represents the variation of plasma parameters across the plasma depletion layer and into the magnetosheath proper. Using this model, we find that many of the properties of the observed spectra follow directly from the predictions of linear Vlasov instability theory. The observed progression of spectral features is a natural progression from mirror mode to merged (in frequency range) proton and He(2+) cyclotron modes to bifurcated (in frequency range) cyclotron modes as plasma convects earthward in the magnetosheath. The necessary change in dispersion surface topology from separated proton and He(2+) cyclotron surfaces at low beta to merged surfaces at high beta is described.

Denton, Richard E.↗

Light Scattering By Nonspherical Particles: Current Status and Challenging Issues

Quantitative analyses of remote sensing measurements of aerosols, clouds, precipitation, and particulate surfaces as well as computations of the Earth's radiation balance require detailed understanding of the interaction of small particles with light and other electromagnetic radiation. The convenient availability of the Lorenz-Mie theory has led to a widespread practice of treating all particles as if they were spheres. However, many natural and anthropogenic particles have nonspherical shapes, and the accumulated knowledge suggests that their scattering and radiative properties can be dramatically different from those of equivalent spheres. This presentation will summarize the recent significant progress achieved in the area of electromagnetic scattering by nonspherical particles and outline major problems that still await solution. The talk will cover the following specific topics: (1) comparison of most widely used exact and approximate theoretical techniques; (2) outline of laboratory and field measurement techniques; (3) compare theory and experiment; (4) need for a statistical approach in dealing with natural particles; (5) remote sensing and radiative transfer applications; and (6) major unsolved problems.

Mishchenko, Michael↗

CTE Measurements of Carbon Fibers in ESEM

The strong appeal of carbon fiber reinforced ceramic matrix and carbon-carbon composites arises from their promising high temperature performance within laboratory-simulated nozzle, leading edge and combustor environments. The main drawback in these systems are two fold; namely oxidation affinity and CTE mismatch. To date the emphasis has been on axial CTE mismatch with the push on estimating (component) laminate level data. However, in heterogeneous and anisotropic systems, all failure mechanisms are at micro or nano scales. This paper will report plans and progress on single carbon fibers efforts in order to develop its temperature dependent, anisotropic thermophysical and thermomechanical properties using combination of x-ray spectroscopy and environmental scanning electron microscopy to capture circumferential expansion from 20-900 C in within the SEM chamber. Surface roughness measurements were also determined. Crystallinity was also determined by the quality of the electron diffraction (ED) patterns.

Effinger, Michael↗

Improving UV Resistance of High Strength Fibers Used In Large Scientific Balloons

For the last three decades, NASA has been involved in the development of giant balloons that are capable of lifting heavy payloads of equipment (such as large telescopes and scientific instruments) to the upper atmosphere. While the use of such balloons has led to scientific discoveries, the demand for competitive science payloads and observational programs continues to rise. The NASA Balloon Program Office has entered a new phase of research to develop an Ultra Long Duration Balloon (ULDB) that will lift payloads of up to 3,600 kg to altitudes of up to 40 km. The flight duration is targeted to ranges between 30 to 100 days. Attaining these target durations requires the development of a super-pressure balloon design. The use of textile structures have already been established in these missions in the form of high strength tendons essential for the super pressure pumpkin design. Unfortunately, high strength fibers lose significant strength upon exposure to Ultra Violet (UV) radiation. Such UV degradation poses a serious challenge for the development of the ULDB. To improve the mission performance of the ULDB, new methods for protecting the tendons from the environmental effects need to be developed. NASA and NC State University College of Textiles are undertaking a research program to address these issues. Four tracks have been identified to prepare finishes that are believed to enhance the resistance of high strength fibers to UV. These tracks are: (a) self-polymerizing, (b) diffusion application, (c) polymer-filled with 30-40% UV absorber, and (d) combination of dyeing plus surface application. Four high performance fibers have been selected for this research investigation. These are Vectran (trademark), Spectra (trademark), Kevlar (trademark) and, PBO (Zylon (trademark)). This work will address the current progress of evaluating the performance of the UV finishes. This will be accomplished by comparing the tensile properties (strength, breaking elongation, modulus, etc) of untreated, unexposed to UV fibers; untreated exposed to UV fibers; and treated exposed to UV fibers.

Said, M.↗

In-Space Recycler Technology Demonstration

In 2014, a 3D printer was installed and used successfully on the International Space Station (ISS), creating the first additively manufactured part in space. While additive manufacturing is a game changing technology for exploration missions, the process still requires raw feedstock material to fabricate parts. Without a recycling capability, a large supply of feedstock would need to be stored onboard, which negates the logistical benefits of these capabilities. Tethers Unlimited, Inc. (TUI), received a Small Business Innovation Research (SBIR) award to design and build the first In-space Recycler for demonstration aboard the ISS in 2017. To fully test this technology in microgravity, parts will be 3D printed, recycled into reusable filament, and then reprinted into new parts. Recycling scrap into printer filament is quite challenging in that a recycler must be able to handle a large variety of possible scrap configurations and densities. New challenges include: dealing with inevitable contamination of the scrap material, minimizing damage to the molecular structure of the plastic during reprocessing, managing a larger volume of hot liquid plastic, and exercising greater control over the cooling/resolidification of the material. TUI has developed an architecture that addresses these challenges by combining standard, proven technologies with novel, patented processes developed through this effort. Results show that the filament diameter achieved is more consistent than commercial filament, with only minimal degradation of material properties over recycling steps. In May 2016, TUI completed fabrication of a flight prototype, which will ultimately progress to the demonstration unit for the ISS as a testbed for future exploration missions. This capability will provide significant cost savings by reducing the launch mass and volume required for printer feedstock as well as reduce waste that must be stored or disposed.

Recycling↗

Neutron matter, symmetry energy and neutron stars

Recent progress in quantum Monte Carlo with modern nucleon-nucleon interactions have enabled the successful description of properties of light nuclei and neutron-rich matter. Of particular interest is the nuclear symmetry energy, the energy cost of creating an isospin asymmetry, and its connection to the structure of neutron stars. Combining these advances with recent observations of neutron star masses and radii gives insight into the equation of state of neutron-rich matter near and above the saturation density. In particular, neutron star radius measurements constrain the derivative of the symmetry energy.

Stefano, Gandolfi↗

Deposition Behavior of Supersaturated Silicic Acid onto Illite as an Altered Backfilling Material - 18114

The pH gradient, which is generated by cement-based materials, causes the deposition of silicic acid in the backfilled tunnels in the repository. This deposition behavior blocks the flow-path, whence it also acts effectively for the retardation of radionuclides besides the similar effect with swelling property. Such deposition effect is expected to be maintained in the backfilling material even after illitization has progressed. The aim of this study is to evaluate the deposition rate constant, k [m/s], of supersaturated silicic acid on illite under some different conditions, considering its temperature dependence. In the experiments, deposition behavior was observed during 6 hours. After adding illite powder into the supersaturated silicic acid solution (pH>10), the pH was set to 8 in order to adjust the solution supersaturated. As a result of these experiments, the values of k were several 10-10 m/s in the temperature range of 288 K to 323 K. Several previous studies with some experiments and numerical simulations showed that the values of k for various minerals, e.g. Ca-type bentonite and amorphous silica, were in the range of 10-11 to 10-10 m/s, and that those values are large enough to clog micro flow-paths. These means that illite shows the clogging effect caused by the deposition of supersaturated silicic acid as in other silicate minerals. In addition, the deposition amount of supersaturated silicic acid increased as the temperature was raised. Therefore, the deposition reaction could progress rapidly under the condition of relatively high temperature caused by the geothermal heat and the waste heat in the repository. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Failure of Non-Circular Composite Cylinders

In this study, a progressive failure analysis is used to investigate leakage in internally pressurized non-circular composite cylinders. This type of approach accounts for the localized loss of stiffness when material failure occurs at some location in a structure by degrading the local material elastic properties by a certain factor. The manner in which this degradation of material properties takes place depends on the failure modes, which are determined by the application of a failure criterion. The finite-element code STAGS, which has the capability to perform progressive failure analysis using different degradation schemes and failure criteria, is utilized to analyze laboratory scale, graphite-epoxy, elliptical cylinders with quasi-isotropic, circumferentially-stiff, and axially-stiff material orthotropies. The results are divided into two parts. The first part shows that leakage, which is assumed to develop if there is material failure in every layer at some axial and circumferential location within the cylinder, does not occur without failure of fibers. Moreover before fibers begin to fail, only matrix tensile failures, or matrix cracking, takes place, and at least one layer in all three cylinders studied remain uncracked, preventing the formation of a leakage path. That determination is corroborated by the use of different degradation schemes and various failure criteria. Among the degradation schemes investigated are the degradation of different engineering properties, the use of various degradation factors, the recursive or non-recursive degradation of the engineering properties, and the degradation of material properties using different computational approaches. The failure criteria used in the analysis include the noninteractive maximum stress criterion and the interactive Hashin and Tsai-Wu criteria. The second part of the results shows that leakage occurs due to a combination of matrix tensile and compressive, fiber tensile and compressive, and inplane shear failure modes in all three cylinders. Leakage develops after a relatively low amount of fiber damage, at about the same pressure for three material orthotropies, and at approximately the same location.

Hyer, M. W.↗

Progress and innovations in the TCV tokamak research programme

Research on the Tokamak à Configuration Variable addresses a wide range of key questions relevant to ITER and future fusion power plants. Over the past two years, highly productive experimental campaigns have led to major advances across several areas: the ITER baseline scenario; pedestal properties in low-collisionality, peeling-limited conditions; and the development of high- β N , non-inductive regimes. Alternative high-confinement scenarios have likewise received significant attention, with remarkable progress in quasi-continuous exhaust operation, X-point radiator plasmas, and negative triangularity configurations. Substantial achievements were also made in the mitigation or benign termination of runaway electron beams, in elucidating fast-ion loss mechanisms, and in improving exhaust behaviour in both conventional and alternative divertor geometries. These experimental results have been strongly supported by advances in modelling and their direct application to the experiment, ranging from gyrokinetic simulations of core and pedestal turbulence to fluid-based studies of scrape-off layer and divertor physics in diverse geometries. Plasma control has taken on an increasingly important role, with model-based and data-driven approaches now closely intertwined with physics studies. This article provides a overview of these recent activities, together with a brief outlook on forthcoming upgrades and next steps.

EPFL↗