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At least 1,351 records · Page 75

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NASA NTRS2011

Radiation Modeling for the Reentry of the Hayabusa Sample Return Capsule

Predicted shock-layer emission signatures of the Japanese Hayabusa capsule during its reentry are presented for comparison with flight measurements made during an airborne observation mission using NASA s DC-8 Airborne Laboratory. For each altitude, lines of sight were extracted from flow field solutions computed using an inhouse high-fidelity CFD code, DPLR, at 11 points along the flight trajectory of the capsule. These lines of sight were used as inputs for the line-by-line radiation code NEQAIR, and emission spectra of the air plasma were computed in the wavelength range from 300 nm to 1600 nm, a range which covers all of the different experiments onboard the DC-8. In addition, the computed flow field solutions were post-processed with the material thermal response code FIAT, and the resulting surface temperatures of the heat shield were used to generate thermal emission spectra based on Planck radiation. Both spectra were summed and integrated over the flow field. The resulting emission at each trajectory point was propagated to the DC-8 position and transformed into incident irradiance. Comparisons with experimental data are shown.

Winter, Michael W.↗

NASA NTRS2019

Radiation Modeling for the Reentry of the Hayabusa Sample Return Capsule

Predicted shock-layer emission signatures during the reentry of the Japanese Hayabusa capsule are presented and compared with flight measurements conducted during an airborne observation mission in NASA's DC-8 Airborne Laboratory. For selected altitudes at 11 points along the flight trajectory of the capsule, lines of sight were extracted from flow field solutions computed using the in-house high-fidelity CFD code, DPLR. These lines of sight were used as inputs for the line-by-line radiation code NEQAIR, and emission spectra of the air plasma were computed in the wavelength range from 300 nm to 1600 nm, a range which covers all of the different experiments onboard the DC-8. In addition, the computed flow field solutions were post-processed with the material thermal response code FIAT, and the resulting surface temperatures of the heat shield were used to generate thermal emission spectra based on Planck radiation. Both spectra were summed and integrated over the flow field. The resulting emission at each trajectory point was propagated to the DC-8 position and transformed into incident irradiance to be finally compared with experimental data.

shock-layer radiation↗

DOE OSTI2023

Serrated flow in $\mathrm{NaI:Tl}$ scintillator crystals

We report the serrated-flow behavior is an important phenomenon that unveils material-deformation mechanisms, as reported for various kinds of materials. NaI doped with Tl (NaI:Tl) is unique among scintillation materials in that the structure contains glide planes that are linked to serration behavior. In the present work, single crystals of NaI:Tl were subjected to room-temperature compression experiments at different strain rates. The serrated flow was observed, and complexity and multifractal analyses were performed to analyze the serration behavior. The findings revealed that the strain rate had a pronounced effect on the complexity and multifractality of the serrated flow, similar to what has been found in other alloy systems. The results also indicate that there may be a strong link between the complexity of the serrated flow behavior and the heterogeneity of the underlying dynamics. It is expected that the present work could be a step toward a better understanding of the deformation behavior and forgeability of NaI:Tl single crystals.

36 MATERIALS SCIENCE↗

NASA NTRS1984

The Mauna Loa sulfur flow as an analog to secondary sulfur flows on Io

Independent evidence suggests that both sulfur and silicate materials exist on the surface of Io. Spectral data indicate the presence of sulfur compounds, some of which are suggested to be of fumarolic origin. Morphological evidence and inferences of the physical properties of some land-forms suggest that silicate volcanism has occurred, which would involve temperatures 650 C or greater. Because the liquidus of sulfur is only about 115 C, it is likely that sulfur in close proximity to 'hot spots' or to active silicate volcanic areas on Io would be melted and mobilized as flows. The Mauna Loa sulfur flow may serve as an analog for such flows, as it consists of fumarolic sulfur that was melted as a consequence of a basaltic eruption and produced a small flow superimposed on silicate lavas.

Greeley, R.↗

NASA NTRS1984

Influence of soft inclusions on the strength of wrought materials

The three dimensional soft particles (such as sulfides, silicates and voids) present in most materials are modelled by circular voids in sheet metal. Relationships are sought between the shape and orientation of a hole after rolling and testing in tension. Then, the effect of hole shape and size on mechanical properties is considered experimentally. The presence of voids has a negligible influence on the ultimate tensile stress of ductile materials based on the unperforated area because plastic flow neutralizes the stress intensification present in the elastic region. However, the shape and orientation of the defects are found to play an important role relative to strain at fracture. In certain engineering applications the strain at fracture is more important than the stress at fracture and in this sense the presence of voids are considered to influence the strength of a ductile material.

Pai, D. M.↗

DOE OSTI2021

Evolution of anisotropy with saturation and its implications for the elastoplastic responses of clay rocks

Many clay rocks have distinct bedding planes. Experimental studies have shown that their mechanical properties evolve with the degree of saturation (DOS), often with higher stiffness and strength after drying. For transversely isotropic rocks, the effects of saturation can differ between the bed-normal (BN) and bed-parallel (BP) directions, which gives rise to saturation-dependent stiffness and strength anisotropy. Accurate prediction of the mechanical behavior of clay rocks under partially saturated conditions requires numerical models that can capture the evolving elastic and plastic anisotropy with DOS. In this study, we present an anisotropy framework for coupled solid deformation-fluid flow in unsaturated elastoplastic media. Here we incorporate saturation-dependent strength anisotropy into an anisotropic modified Cam-Clay (MCC) model and consider the evolving anisotropy in both the elastic and plastic responses. The model was calibrated using experimental data from triaxial tests to demonstrate its capability in capturing strength anisotropy at various levels of saturation. Through numerical simulations, we demonstrate the role of evolving stiffness and strength anisotropy in the mechanical behavior of clay rocks. Plane strain simulations of triaxial compression tests were also conducted to demonstrate the impacts of material anisotropy and DOS on the mechanical and fluid flow responses.

36 MATERIALS SCIENCE↗

DOE OSTI2024

Curves, Coriolis, and Cross-Channel Circulation in the Hudson River Estuary

Abstract Despite its relatively small magnitude, cross-channel circulation in estuaries can influence the along-channel momentum balance, dispersion, and transport. We investigate spatial and temporal variation in cross-channel circulation at two contrasting sites in the Hudson River estuary. The two sites differ in the relative strength and direction of Coriolis and curvature forcing. We contrast the patterns and magnitudes of flow at the two sites during varying conditions in stratification driven by tidal amplitude and river discharge. We found well-defined flows during flood tides at both sites, characterized by mainly two-layer structures when the water column was more homogeneous and structures with three or more layers when the water column was more stratified. Ebb tides had generally weaker and less definite flows, except at one site where curvature and Coriolis reinforced each other during spring tide ebbs. Cross-channel currents had similar patterns, but were oppositely directed at the two sites, demonstrating the importance of curvature even in channels with relatively gradual curves. Coriolis and curvature dominated the measured terms in the cross-channel momentum balance. Their combination was generally consistent with driving the observed patterns and directions of flow, but local acceleration and cross-channel advection made some notable contributions. A large residual in the momentum balance indicates that some combination of vertical stress divergence, baroclinic pressure gradients, and along-channel and vertical advection must play an essential role, but data limitations prevented an accurate estimation of these terms. Cross-channel advection affected the along-channel momentum balance at times, with implications for the exchange flow’s strength. Significance Statement Currents that flow across the channel in an estuary move slower than those flowing along the channel, but they can transport materials and change water properties in important ways, affecting human uses of estuaries such as shipping, aquaculture, and recreation. We wanted to better understand cross-channel currents in the Hudson River estuary. We found that larger tides produced the strongest cross-channel currents with a two-layer pattern, compared to weaker currents with three layers during smaller tides. Higher or lower river flow also affected current strength. Comparing two locations, we saw cross-channel currents moving in opposite directions because of differences in the curvature of the river channel. Our results show how channel curvature and Earth’s rotation combine to produce cross-channel currents.

Conley, Margaret M.↗

DOE OSTI2021

Holistic design principles for flow batteries: Cation dependent membrane resistance and active species solubility

Cation dependent resistance of a commercial cation exchange membrane, Nafion™ 212, as well as the solubility of select active materials are investigated, demonstrating practical consequences of cation choice on redox flow battery (RFB) performance. The conductivity of alkali and methyl- or -alcohol substituted ammonium cations through pretreated Nafion™ 212 reveal that cation size is the dominant factor affecting ionic transport. Among the alkali series the resistance increases with larger ionic radii and similarly, with increasing steric bulk through substitution on ammonia. The solubility of ferrocyanide, a commonly used redox flow battery posolyte (or catholyte), as well as iron, cobalt, and chromium metal-organic compounds are determined for the same series of cations. Full cells are assembled using various cation mixtures and membrane pre-treatments to demonstrate practical effects of each variable. Here, we highlight the need to carefully select the correct cations for efficient electrolyte design, since certain cations may lead to high conductivity but low solubility, or vice versa, and provide design principles for RFBs using Nafion™ 212.

25 ENERGY STORAGE↗

DOE OSTI2021

Stability-based optimization of ACRT for the growth of CZT by the traveling heater method

Numerical modeling is employed to study the effects of several accelerated crucible rotation technique (ACRT) rotation schedules on the growth of cadmium zinc telluride (CZT) by the traveling heater method (THM). In conjunction with these analyses, a measure is developed to estimate the amplitude of disturbances associated with cellular interface growth morphologies that develop over time and across the melt-solid interface. Furthermore, this disturbance amplitude measure is used to assess the ability of ACRT to stabilize the growth interface and thereby minimize inclusion formation processes. Notably, our analyses reveal that interfacial instability is not well correlated with melt undercooling, explaining why classical ACRT approaches to reduce undercooling by mixing may not stabilize growth. Computations show that interface stability is best achieved via rotation schedules that accentuate outward Ekman flows during spin-up and, during spin-down, eliminate Taylor-Görtler flows and minimize inward Ekman flows.

36 MATERIALS SCIENCE↗

NASA NTRS1978

The mantle of Mars - Some possible geological implications of its high density

The high density of the Martian mantle probably implies an iron-rich composition expressed by a higher concentration of FeO than that in the earth's mantle. Examination of high-pressure mineralogies suggests that the model Martian mantle has an oxide-garnet wehrlite phase assemblage. This mantle model would be likely to yield ultrabasic (ferrobasaltic) melts of very low viscosity. The prevalence of low-viscosity material is consistent with large eruption rate and copious lava flow on the planet. Furthermore, ferro-kimberlite volcanic ash may be an abundant constituent in the Martian soil, especially if there was much volatile material within the early accreting Mars.

Mcgetchin, T. R.↗

NASA NTRS1999

Effects of g-Jitter on Diffusion in Binary Liquids

The microgravity environment offers the potential to measure the binary diffusion coefficients in liquids without the masking effects introduced by buoyancy-induced flows due to Earth s gravity. However, the background g-jitter (vibrations from the shuttle, onboard machinery, and crew) normally encountered in many shuttle experiments may alter the benefits of the microgravity environment and introduce vibrations that could offset its intrinsic advantages. An experiment during STS-85 (August 1997) used the Microgravity Vibration Isolation Mount (MIM) to isolate and introduce controlled vibrations to two miscible liquids inside a cavity to study the effects of g-jitter on liquid diffusion. Diffusion in a nonhomogeneous liquid system is caused by a nonequilibrium condition that results in the transport of mass (dispersion of the different kinds of liquid molecules) to approach equilibrium. The dynamic state of the system tends toward equilibrium such that the system becomes homogeneous. An everyday example is the mixing of cream and coffee (a nonhomogeneous system) via stirring. The cream diffuses into the coffee, thus forming a homogeneous system. At equilibrium the system is said to be mixed. However, during stirring, simple observations show complex flow field dynamics-stretching and folding of material interfaces, thinning of striation thickness, self-similar patterns, and so on. This example illustrates that, even though mixing occurs via mass diffusion, stirring to enhance transport plays a major role. Stirring can be induced either by mechanical means (spoon or plastic stirrer) or via buoyancy-induced forces caused by Earth s gravity. Accurate measurements of binary diffusion coefficients are often inhibited by buoyancy-induced flows. The microgravity environment minimizes the effect of buoyancy-induced flows and allows the true diffusion limit to be achieved. One goal of this experiment was to show that the microgravity environment suppresses buoyancy-induced convection, thereby mass diffusion becomes the dominant mechanism for transport. Since g-jitter transmitted by the shuttle to the experiment can potentially excite buoyancy-induced flows, we also studied the effects of controlled vibrations on the system.

Duval, Walter M. B.↗

DOE OSTI2025

Analysis of anion exchange membrane water electrolyzer performance and its evolution over time

Understanding water, evolved gas, and ionic transport in membrane-electrode-assemblies (MEAs) is essential for the development of high performance and durable anion exchange membrane water electrolyzers (AEMWEs). This study evaluates the MEA conditioning process, operating conditions, and short-term stability in a 1 M potassium hydroxide (KOH) electrolyte, focusing on the underlying transport phenomena. We observe a significant initial voltage loss in continuous cell operation, which could be associated with gas bubble accumulation, transport layer or flow field passivation, and changes in the catalyst oxidation state. Further, we investigate the effects of materials and operational configurations, including the membrane type and thickness, and the electrolyte flow rate, including KOH being fed to both electrodes as well as to the anode only. Furthermore, the effect of membrane drying temperature on ex situ as well as in situ electrochemical performance is evaluated. Finally, we discuss 700 h of AEMWE operation at 1 A/cm 2 , highlighting the underlying degradation phenomena.

25 ENERGY STORAGE↗

DOE OSTI2022

Autonomous continuous flow reactor synthesis for scalable atom-precision

With new instrumentation design, robotics, and in-operando hyphenated analytical tool automation, the intelligent discovery of synthesis pathways is becoming feasible. It can potentially bridge the gap for the scale-up of new materials. In this article, we review current progress and describe a new system that uses an autonomous continuous flow chemistry framework to translate high-quality lead molecules and materials to quantities that can meet scalability demands. At the core is a continuous flow synthesis platform that can design its viable synthesis pathway to a particular molecule or material and then autonomously carry it out. This is realized by integrating: (1) A workflow/architecture for multimode chemical/materials characterization in-line. The in-line characterization modes are NMR, ESR, IR, Raman, UV-Vis, GC-MS, and HPLC, along with ex-situ modes for X-Ray and neutron scattering; (2) Integration for feedback/analysis/data storage of the control variables; (3) A core software stack that includes deep learning and reinforcement learning alongside quantum chemistry and molecular dynamics; (4) On-demand compute architectures that parse calculations to compute resources needed which include light-weight edge, mid-level edge (NVIDA DGX-2), and high-performance computing. We demonstrate preliminary results on how this autonomous reactor system can enhance our ability to deliver deuterated materials, copolymers, and site-substituted molecules.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2025

Thermal oxidation of nuclear graphite and pyrolytic carbon coatings

The oxidation of pyrolytic carbon (PyC) deposited via fluidized bed chemical vapor deposition was characterized and compared with that of standard nuclear-grade graphite. The materials were heated at 700 to 1000 °C in a thermogravimetric analysis system under 20% v/v O 2 flow, allowing for direct comparison of dynamic oxidative mass change in each material. Further, three different PyC samples fabricated under different conditions exhibited variation in total mass loss and mass loss rate, varying by as much as 709 mg/cm 2 in total mass loss and 14.2 (mg/cm 2 )/min in mass loss rate at a single temperature. These variations highlight the correlation between PyC microstructure/defect density and oxidation susceptibility. Additionally, changes in the microstructure and composition between PyC and graphite were characterized via scanning electron microscopy and correlated to the mass loss results. The results of this work have implications toward the safety of tristructural isotropic (TRISO) and other coated particle fuels, especially under off-normal conditions, given the limited information that exists about the oxidation behavior of PyC.

36 MATERIALS SCIENCE↗

NASA NTRS1990

Trace element and isotopic effects arising from magma migration beneath mid-ocean ridges

The trace element concentrations and isotopic ratios in the magma erupted on mid-ocean ridges may differ from those in the source material due to physical effects such as porous flow dispersion, exchange of trace elements between the fluid and solid phases during magma migration, and convective mixing in magma chambers. These differences are in addition to those produced by better known processes such as fractional crystallization and partial melting. The effects of the three former processes are described. It is predicted that magma typically reaches the subridge magma chambers with a spatial heterogeneity only slightly reduced from that of the source material, but with a subdued variation in time. Convective mixing then further reduces the spatial heterogeneity. Application of the results for convective mixing to a recent Fourier analysis of Sr-87/Sr-86 variations along the Mid-Atlantic Ridge suggests that the falloff in amplitude of variation observed with decreasing wavelength in the Mid-Atlantic Ridge data cannot be explained by convective mixing in magma chambers. Instead, it is postulated that this falloff is due to the mechanics of the production and/or the solid-state convective mixing of chemical and isotopic heterogeneities in the solid mantle.

Kenyon, Patricia M.↗

NASA NTRS1999

Fire Safety in the Low-Gravity Spacecraft Environment

Research in microgravity (low-gravity) combustion promises innovations and improvements in fire prevention and response for human-crew spacecraft. Findings indicate that material flammability and fire spread in microgravity are significantly affected by atmospheric flow rate, oxygen concentration, and diluent composition. This information can lead to modifications and correlations to standard material-assessment tests for prediction of fire resistance in space. Research on smoke-particle changes in microgravity promises future improvements and increased sensitivity of smoke detectors in spacecraft. Research on fire suppression by extinguishing agents and venting can yield new information on effective control of the rare, but serious fire events in spacecraft.

Friedman, Robert↗

NASA NTRS1994

Global, quasi-steady dynamics of the distant solar wind 2: Deformation of the heliospheric current sheet

A three-dimensional (3-D) magnetohydrodynamic (MHD) numerical model is used to trace global deformations of the heliospheric current sheet (HCS) caused by large-scale dynamical interactions associated with corotating solar wind flows. Configurations incorporating the tilted-dipole geometry are investigated out past 30 AU for a variety of dipole tilt angles, alpha. Inclusion of the full, 3-D interplanetary dynamics allows north-south displacements and the east-west warping of the HCS by advective corotational effects to be accurately assessed for the first time. It is found that large-scale spatial correlations between velocity and density imposed at the coronal source (i.e., the geometric arrangement whereby regions of high-speed low-density material lying adjacent to areas of slow, dense flow interact obliquely under the influence of solar rotation) result in a distinctive pattern of deformation of the HCS. For an alpha = 30 deg tilted-dipole example, it is shown that typical zonal variations in radial velocity lead to significant folding of the HCS within about 5 AU of the Sun. By 10 AU, additional sharp bends appear near the latitudinal extremes of the HCS surface, where it is overtaken by shock fronts driven by 3-D corotating interaction regions (CIRs). Moreover, the model suggests that inside about 20 AU, major plasma structures are systematically organized, about the HCS, such that the greatest concentrations of material and magnetic field (the centroids of the 3-D CIR structures) are coincident with the folded crests of the HCS (near heliographic latitudes lambda = +/- alpha). Thus, in these circumstances many of the more interesting dynamical features inconveniently lie well away from the heliographic equator. At larger heliocentric distances, where neighboring CIRs begin to interact strongly, the warping of the HCS abates dramatically and the association between folds in the HCS and major field and density concentrations is weakened and ultimately breaks down. On the basis of the model calculations, quasi-steady deformations and related phenomena should figure prominently in the interplanetary medium, except during those periods when the magnetic dipole and solar spin axes are nearly aligned (alpha is approximately less than 10 deg). Even then, they may be of significance if there are any substantial local warps or kinks in the streamer belt.

Pizzo, V. J.↗

DOE OSTI2025

Large-scale experimental validation of thermochemical water-splitting oxides discovered by defect graph neural networks

Thermochemical water-splitting (TCH) based on 2-step thermal redox cycles in metal oxides is a promising approach to generating H 2 , but state-of-the-art (SOTA) CeO 2 has several practical limitations, which has motivated continued materials discovery efforts in this field. Here, in this study, we improve upon a SOTA defect graph neural network (dGNN) surrogate model's oxygen vacancy predictions and combine them with materials project phase diagrams to down-select and discover structurally diverse, experimentally known metal oxides whose TCH performance was previously unknown. Amongst twelve candidates selected based on our high-throughput screening and down-selection criteria, we achieved ∼80% accuracy in identifying materials with stable redox cycling and hydrogen production in stagnation flow reactor water-splitting experiments. Closer to 100% accuracy can be achieved if higher-accuracy, hybrid DFT-predicted vacancy formation energies were computed and used in lieu of the most uncertain dGNN-based screening predictions, as they correct false positives to true negatives. Notably, two discovered candidates, Sr 3 PrMn 2 O 8 and Ba 2 Fe 2 O 5 , display hydrogen yields greater than CeO 2 under specific redox conditions. In conclusion, these results demonstrate our ability to computationally predict and experimentally validate promising candidate TCH materials that have the potential to compete with CeO 2 .

08 HYDROGEN↗