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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

Effective thermal property improves phase change paint data

The phase-change coating technique presents itself as a valuable tool in determining the heat transfer rate over the surface of small complex wind tunnel models. A numerical technique is described which shows that an effective thermophysical property - the square root of the product of thermal conductivity, density, and specific heat - may significantly improve the accuracy of the phase-change coating technique with allowance for model inhomogeneity and temperature dependency in a transient environment. Results of the measured steady-state variation of the effective thermophysical property with temperature and the effect of surface heating rate on the effective thermophysical property are plotted for a representative homogeneous model material and for an extreme nonhomogeneous model material. The use of an effective thermophysical property to reduce phase-change paint data is recommended. The analysis also confirms that the apparatus described by Corwin and Kramer (1975) can be used to measure directly this effective thermophysical property for use in wind tunnel model heat-transfer measurements.

Drummond, J. P.↗

H-tailored surface conductivity in narrow band gap In(AsN)

We show that the n-type conductivity of the narrow band gap In(AsN) alloy can be increased within a thin (∼100 nm) channel below the surface by the controlled incorporation of H-atoms. This channel has a large electron sheet density of ∼10{sup 18 }m{sup −2} and a high electron mobility (μ > 0.1 m{sup 2}V{sup −1}s{sup −1} at low and room temperature). For a fixed dose of impinging H-atoms, its width decreases with the increase in concentration of N-atoms that act as H-traps thus forming N-H donor complexes near the surface.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Probing phonon softening in ferroelectrics by scanning probe microwave spectroscopy

Microwave measurements have recently been successfully applied to measure ferroelectric materials on the nanoscale, including detection of polarization switching and ferroelectric domain walls. In this study we discuss the question of whether scanning probe microscopy operating at microwave frequency can identify the changes associated with the soft phonon dynamics in a ferroic. The analytical expressions for the electric potential, complex impedance, and dielectric losses are derived and analyzed, since these physical quantities are linked to experimentally measurable properties of the ferroic. As a ferroic we consider virtual or proper ferroelectric with an optic phonon mode that softens at a Curie point. We also consider a decay mechanism linked to the conductance of the ferroic, thus manifesting itself as the dielectric loss in the material. Our key finding is that the influence of the soft phonon dispersion on the surface potential distribution, complex impedance, and dielectric losses are evidently strong in the vicinity (~10–30 K) of the Curie temperature. Additionally, we quantified how the spatial distribution and frequency spectra of the complex impedance and the dielectric losses react on the dynamics of the soft phonons near the Curie point. These results set the stage for characterization of polar phase transitions with nanoscale microwave measurements, providing a complementary approach to well established electromechanical measurements for fundamental understanding of ferroelectric properties as well as their applications in telecommunication and computing.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Rayleigh Wave Propagation in the Bighorn Mountains Region, Wyoming

Short-period Rayleigh waves, Rg , provide strong constraints on the depth of shallow seismic events and are of interest for monitoring small explosions. Characterizing the seismic sources that generate Rg requires an understanding of how shallow crustal structure affects Rayleigh wave propagation. Here, in support of these efforts, this study utilizes observed waveforms from small shallow explosions recorded on temporary seismic network deployments in the Bighorn region, Wyoming. We study regional near-surface geology by measuring changes in surface-wave amplitude and polarization during propagation through basins, foothills, and mountains. We develop additional insight by carrying out surface-wave eigenfunction analyses and numerical-wave simulations, which together reproduce many characteristics seen in the observed waveforms. Our results show how sedimentary basins in the Bighorn region allow for amplified prograde-polarized higher-mode and retrograde-polarized fundamental-mode Rayleigh waves, whereas adjacent mountains only support retrograde motion. These different modes provide distinct constraints on the Earth structure and source characteristics, potentially enabling targeted inversions in future studies. Finally, our findings provide insight into Rg propagation through complex near-surface geology, improving our understanding of shallow propagation and source effects that are relevant to explosion monitoring efforts.

58 GEOSCIENCES↗

Review of Computer-Aided Manufacturing (CAM) strategies for hybrid directed energy deposition

Hybrid additive manufacturing intertwines both additive and subtractive manufacturing layer by layer to digitally fabricate parts with complex geometries, improved surface finish and tight dimensional accuracies, the sum of which is difficult to obtain with any single process. Computer-Aided Manufacturing (CAM) software is required to orchestrate the machine toolpathing for both the deposition as well as the machining processes and is crucial for the successful fabrication of high quality structures. Additionally, CAM requires substantial operator input to account for challenging aspects of each fabricated structure. For example, deciding at which layer of deposition will the machining process continue to maintain access to complex cavities for finishing - internal features that would otherwise be unfinishable due to reach limitations or obstructions. Moreover, of the many commercially-available hybrid systems, each has a unique kinematic environment which can benefit from specific optimization of toolpath planning and substantial research has directly correlated toolpathing with the microstructure evolution, mechanical properties, porosity and residual stress state of the final fabricated part. This review explores the available strategies for CAM in the context of hybrid direct energy deposition, discusses the advantages and disadvantages of each and considers future CAM trends for this transformational digital manufacturing technology.

36 MATERIALS SCIENCE↗

Evaluation of Sedimentary Structure Near the Advanced Test Reactor Complex at the Idaho National Laboratory

An analysis of relevant sediment stratigraphy near Idaho National Laboratory’s Advanced Test Reactor Complex in support of the proposed remote-handled low-level waste disposal facility is presented. The scope of analysis includes a geostatistical evaluation of sedimentary interbed top elevations and thicknesses compiled for wells near the Advanced Test Reactor Complex from land surface to the elevation of the water table. It also includes an evaluation of expected sediment texture and composition based on information contained in existing reports. Finally, based on this analysis, recommendations for characterization well spacing and appropriate transport model dimensionality are made.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

A rolling-sliding bench test for investigating rear axle lubrication

An automotive rear axle is composed of a set of hypoid gears, whose contact surfaces experience a complex combination of rolling contact fatigue damage and sliding wear. Full-scale rear axle dynamometer tests are used in the industry for efficiency and durability assessment. Here, this study developed a bench-scale rolling-sliding test protocol by simulating the contact pressure, oil temperature, and lubrication regime experienced in a dynamometer duty cycle test. Initial bench results have demonstrated the ability of generating both rolling contact-induced micropitting and sliding wear and the feasibility of investigating the impact of slide-to-roll ratio, surface roughness, test duration, and oil temperature on the friction behavior, vibration noise, and surface damage. Finally, this bench test will allow studying candidate rear axle lubricants and materials under relevant conditions.

42 ENGINEERING↗

Probing three-dimensional mesoscopic interfacial structures in a single view using multibeam X-ray coherent surface scattering and holography imaging

Abstract Visualizing surface-supported and buried planar mesoscale structures, such as nanoelectronics, ultrathin-film quantum dots, photovoltaics, and heterogeneous catalysts, often requires high-resolution X-ray imaging and scattering. Here, we discovered that multibeam scattering in grazing-incident reflection geometry is sensitive to three-dimensional (3D) structures in a single view, which is difficult in conventional scattering or imaging approaches. We developed a 3D finite-element-based multibeam-scattering analysis to decode the heterogeneous electric-field distribution and to faithfully reproduce the complex scattering and surface features. This approach further leads to the demonstration of hard-X-ray Lloyd’s mirror interference of scattering waves, resembling dark-field, high-contrast surface holography under the grazing-angle scattering conditions. A first-principles calculation of the single-view holographic images resolves the surface patterns’ 3D morphology with nanometer resolutions, which is critical for ultrafine nanocircuit metrology. The holographic method and simulations pave the way for single-shot structural characterization for visualizing irreversible and morphology-transforming physical and chemical processes in situ or operando .

47 OTHER INSTRUMENTATION↗

Scalable Hot-Water-Repellent Superhydrophobicity via Thermal Insulation

Superhydrophobic surfaces, which rely on a combination of surface texture and chemistry, often lose their repellent behavior when contacted by hot water (≳40 °C) because the impinging hot water replaces the requisite air layer within the surface texture via evaporation and recondensation. In contrast to previous approaches targeting this condensation-induced failure mode that rely on intricately tailored surface structures or complex chemical treatments, we present a scalable approach based on thermal design: the multilayered insulated superhydrophobic (MISH) coating mitigates condensation-induced failure by preventing heat transfer. Superhydrophobicity is retained at impinging water temperatures up to 90 °C, with durability demonstrated via long-term (>1 million impacts) droplet impingement experiments. We explain the mechanism for this approach with a detailed thermal model; the model reveals that the underlying physical behavior is self-similar across coating parameters and impinging fluid temperatures. Finally, the MISH coating accommodates curved geometries and large surfaces, and it is over 4 orders of magnitude less expensive than cleanroomnanofabricated alternatives, indicating promise for practical use in the energy sector, chemical processing, and the food and medical industries.

coating materials↗

Technical Report: Final

The objective of this work was to develop catalyzed nanoporous materials that have superior hydrogen uptake between 300K and 400K and moderate pressures. Platinum nanoparticles were introduced to both activated carbons (ACs) and microporous metal organic frameworks (MMOFs) in order to dissociate molecular hydrogen into an active hydrogen species that diffuses from the catalyst to weakly chemisorbs to the AC/MMOF support; this combined sequence is referred to as the hydrogen spillover mechanism. For all materials studied, maximum excess hydrogen uptake was 1-1.4 wt% (excess) at 300K, falling short of DOE storage goals (5.5 wt% by 2015). Select Pt/AC materials (after in situ catalyst activation) had high uptake (up to 1.4 wt%) at low pressure which significantly exceeded that expected for physisorption. The uptake was not correlated to size of Pt catalyst, but appeared to be associated with high surface activity of the AC support and the methodology of catalyst doping. Multiple techniques were explored to introduce Pt nanoparticles into MMOFs, but most led to significant structural degradation. Ultimately, a ‘pre-bridge’ (PB) technique was used to introduce Pt/AC catalysts into MMOFs, as the PB technique led to virtually non-detectable changes in structure. At high pressure, hydrogen spillover of ~1 wt% (excess) to a PB-MMOF was very slow (i.e. >80 hours at 70-80 bar), which can be attributed to high diffusion barriers in a complex three-surface domain material (Pt, AC, MMOF) as well as unexpected evidence for mechanical instability of the undoped MMOF precursor. In a low-pressure comparison study of three PB-MMOFs, we found evidence that the doping technique may introduce defects which may contribute to enhanced adsorption at 300K. However, we could not rule out the effect of active Pt sites, as common predictors of adsorption generally favored the materials without Pt. Furthermore, spectroscopic evidence provided definitive evidence of weak hydrogen chemisorption to two MMOFs and AC, and was found only for materials containing Pt catalyst. Overall, high uptake via hydrogen spillover requires high catalytic activity and an energy neutral surface landscape for ready diffusion, with little to no correlation to the size of the Pt nanoparticle or textural properties (i.e. surface area or porosity) of the AC or MMOF support.

08 HYDROGEN↗

Finite-Difference Simulation for Infrasound Generated by Finite-Extent Ground Motions

Underground explosions can produce infrasound in the atmosphere, and the wavefield characteristics are often governed by the ground surface motions. Finite-difference methods are popular for infrasound simulation as their generality and robustness allow for complex atmospheric structures and surface topography. A simple point-source approximation is often used because infrasound wavelengths tend to be large relative to the source dimensions. However, this assumption may not be able to capture the complexity of explosion-induced ground motions if the surface area is not compact, and appropriate source models must be incorporated into the finite-difference simulations for accurate infrasound prediction. In this study, we develop a point source representation of the complex ground motions for infrasound sources. Instead of a single point source, we use a series of point sources distributed over the source area. These distributed point sources can be equivalent to air volume changes produced by the ground motions in the atmosphere. Further, we apply the distributed point-source method to a series of buried chemical explosions conducted during the Source Physics Experiment Phase I. Epicentral ground-motion measurements during the experiments provide a way to calculate accurate distributed point sources. We validate and evaluate the accuracy of distributed point source approach for infrasound simulations by direct comparison with acoustic observations in the field experiment.

58 GEOSCIENCES↗

Interplay of Surface and Interior Modes in Exciton–Phonon Coupling at the Nanoscale

Exciton-phonon coupling (EXPC) plays a key role in the optoelectronic properties of semiconductor nanocrystals (NCs), but a microscopic picture of EXPC is still lacking, particularly regarding the magnitude and scaling with NC size, the dependence on phonon frequency, and the role of the NC surface. The computational complexity associated with accurately describing excitons and phonons has limited previous theoretical studies of EXPC to small NCs, noninteracting electron-hole models, and/or a small number of phonon modes. We develop an atomistic approach for describing EXPC in NCs of experimentally relevant sizes. We validate our approach by calculating the reorganization energies, a measure of EXPC, for CdSe and CdSe-CdS core-shell NCs, finding good agreement with experimental measurements. We demonstrate that exciton formation distorts the NC lattice primarily along the coordinates of low-frequency acoustic modes. Modes at the NC surface play a significant role in smaller NCs while interior modes dominate for larger systems.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

Opportunities in the Synthesis and Design of Radioactive Thin Films and Nanoparticles

Studies of radioactive isotopes at the liquid-solid or gas-solid interface are enabling a detailed mechanistic understanding the effects of radioactive decay on physical, biological, and chemical systems. In recent years, there has been a burgeoning interest in using radioactive isotopes for both imaging and therapeutic purposes by attaching them to the surface of colloidal nanoparticles. By merging the field of nanomedicine with the more mature field of internal radiation therapy, researchers are discovering new ways to diagnose and treat cancer. In this perspective, we discuss state-of-the-art radioactive thin films as applied to both well-defined surfaces and more complex nanoparticles. Here, we highlight the design considerations that are unique to radioactive films, which originate from the damaging and potentially self-destructive emissions produced during radioactive decay and highlight future opportunities in the largely underexplored area between radioisotope chemistry and nanoscience.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Inferring Geothermal Reservoir Processes at the Raft River Geothermal Field, Idaho, USA, Through Modeling InSAR-Measured Surface Deformation

Ground surface deformations detected with Interferometric Synthetic Aperture Radar (InSAR) provide valuable information for inferring subsurface reservoir processes that are difficult to observe directly. This study aims at building a reservoir model that honors the available geological, hydrological and geo-mechanical data and also produces ground surface deformation consistent with InSAR measurements at the Raft River Geothermal Field. In the thermo-hydro-mechanical (THM) coupled model developed, the reservoir deforms as a result of the rock’s poroelastic response to changes in hydrologic pressure and thermal expansion/contraction. The results indicate that the observed deformation is the result of pressure decrease in the deep production reservoir and pressure increase in a shallower reservoir that accommodates the injected fluid (likely in the Salt Lake Formation). The combination of the uplift around injection wells with subsidence around the production wells, affected by the Bridge Fault as a flow barrier, creates a complex pattern of surface deformation in which the center of subtle subsidence significantly deviates from the location of the production wells. A parametric study suggests that (1) the Bridge Fault Zone is likely a flow barrier, (2) the surface deformation appears to be insensitive to the presence of the Narrows Structure, and (3) additional flow barriers likely exist to shape the flow system. This case study demonstrates the utility of a high-fidelity forward model that honors available known information and THM coupled processes in understanding geothermal reservoir characteristics.

58 GEOSCIENCES↗

Selection of Surfaces for Endurance Tests of Ball End Mills

Standard operating conditions of ball end mills are considered. A set of surfaces whose machining simulates the production of complex curved shapes is formulated. Surfaces for duration tests of the spherical part of ball end mills are selected.

42 ENGINEERING↗

Identification of Au–S complexes on Au(100)

In this study, using a combination of scanning tunneling microscopy and density functional theory (DFT) calculations, we have identified a set of related Au–S complexes that form on Au(100), when sulfur adsorbs and lifts the hexagonal surface reconstruction. The predominant complex is diamond-shaped with stoichiometry Au 4 S 5 . All of the complexes can be regarded as combinations of S–Au–S subunits. The complexes exist within, or at the edges of, p(2 × 2) sulfur islands that cover the unreconstructed Au regions, and are observed throughout the range of S coverage examined in this study, 0.009 to 0.12 monolayers. A qualitative model is developed which incorporates competitive formation of complexes, Au rafts, and p(2 × 2) sulfur islands, as Au atoms are released by the surface structure transformation.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Complete information acquisition in scanning probe microscopy

In the last three decades, scanning probe microscopy (SPM) has emerged as a primary tool for exploring and controlling the nanoworld. A critical part of the SPM measurements is the information transfer from the tip-surface junction to a macroscopic measurement system. This process reduces the many degrees of freedom of a vibrating cantilever to relatively few parameters recorded as images. Similarly, the details of dynamic cantilever response at sub-microsecond time scales of transients, higher-order eigenmodes and harmonics are averaged out by transitioning to millisecond time scale of pixel acquisition. Hence, the amount of information available to the external observer is severely limited, and its selection is biased by the chosen data processing method. Here, we report a fundamentally new approach for SPM imaging based on information theory-type analysis of the data stream from the detector. This approach allows full exploration of complex tip-surface interactions, spatial mapping of multidimensional variability of material s properties and their mutual interactions, and SPM imaging at the information channel capacity limit.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

Surface and Flow Field Measurements on the FAITH Hill Model

A series of experimental tests, using both qualitative and quantitative techniques, were conducted to characterize both surface and off-surface flow characteristics of an axisymmetric, modified-cosine-shaped, wall-mounted hill named "FAITH" (Fundamental Aero Investigates The Hill). Two separate models were employed: a 6" high, 18" base diameter machined aluminum model that was used for wind tunnel tests and a smaller scale (2" high, 6" base diameter) sintered nylon version that was used in the water channel facility. Wind tunnel and water channel tests were conducted at mean test section speeds of 165 fps (Reynolds Number based on height = 500,000) and 0.1 fps (Reynolds Number of 1000), respectively. The ratio of model height to boundary later height was approximately 3 for both tests. Qualitative techniques that were employed to characterize the complex flow included surface oil flow visualization for the wind tunnel tests, and dye injection for the water channel tests. Quantitative techniques that were employed to characterize the flow included Cobra Probe to determine point-wise steady and unsteady 3D velocities, Particle Image Velocimetry (PIV) to determine 3D velocities and turbulence statistics along specified planes, Pressure Sensitive Paint (PSP) to determine mean surface pressures, and Fringe Imaging Skin Friction (FISF) to determine surface skin friction (magnitude and direction). This initial report summarizes the experimental set-up, techniques used, data acquired and describes some details of the dataset that is being constructed for use by other researchers, especially the CFD community. Subsequent reports will discuss the data and their interpretation in more detail

Bell, James H.↗