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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 991 records · Page 55
All sourcesNASA NTRSDOE OSTI
NASA NTRS1981

Implications of natural sources for the latitudinal gradients of NO/y/ in the unpolluted troposphere

The latitudinal distributions of tropospheric odd nitrogen (NO/y/) due to lightning discharges and stratospheric injection are studied by estimating latitude dependences of the sources and the rainout sink from data obtained in August-September, 1977, and May-June, 1978, during project GAMETAG. A one-dimensional (latitude dependent) model is developed for the annually, zonally, and vertically averaged concentration of trace species, NO(y) being treated as a single species, which decouples the NO(y) calculation from the rest of the model since NO(y) has no chemical sources or sinks in the troposphere. The equation governing the NO(y) distribution is solved using finite differences with 33 uniformly spaced grid points in the micron range of -1 to 1. The distribution due to the stratospheric source has a minimum in the tropics, and there are broad maxima centered in the 25-30 degree region in both hemispheres. The calculated NO(y) due to lightning has a maximum near 15 degrees S, and it decreases to nearly a fourth of the maximum value near the poles. The drop off from the maximum is sharper in the Southern Hemisphere in comparison with the Northern Hemisphere.

Hameed, S.↗
DOE OSTI2024

Progress towards edge-localized mode suppression via magnetic perturbations in hydrogen plasmas

Abstract The suppression of edge-localized modes (ELMs) by applying resonant magnetic perturbations (RMPs) is well studied in low collisionality deuterium plasmas as a measure to reduce transient divertor heat loads. However, ELM suppression has yet to be demonstrated in non-nuclear fuels such as hydrogen and hydrogen + helium mixtures which are the main ion species to be used in the ITER pre-fusion power operation (PFPO) phase. For the first time, attempts have been made to access ELM suppression with RMPs in ITER-like low collisionality hydrogen plasmas at DIII-D and ASDEX Upgrade. The DIII-D experiments focused on operation with injected power slightly above the L–H power threshold similar to the expected conditions in the ITER PFPO phase with limited external heating power. The RMPs were found to trigger H–L backtransitions, which is shown to be avoided by reducing the L–H power threshold by diluting the plasma with helium. The additional helium combined with a larger measured neutral density of hydrogen inside the separatrix compared to ELM suppressed deuterium plasmas precluded access to a pedestal top density below the known RMP-ELM suppression threshold. At ASDEX Upgrade, RMP-ELM suppression has been achieved when the concentration of 1 H in the hydrogen isotope mix is below 40 % . While all known access criteria for RMP-ELM suppression were met above this threshold, full ELM suppression was replaced by strong mitigation. The most prominent difference between the hydrogen and deuterium plasmas was a change of turbulence characteristics in the pedestal where Doppler reflectometry measurements suggest a significant reduction of turbulence even at small hydrogen concentrations. In conclusion, these experiments not only identify issues that may prevent access to RMP-ELM suppression in the ITER PFPO phase, but also highlight missing physics in our current understanding of RMP-ELM suppression such as potentially the role of turbulence in the pedestal gradient region.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2024

Can Error Mitigation Improve Trainability of Noisy Variational Quantum Algorithms?

Variational Quantum Algorithms (VQAs) are often viewed as the best hope for near-term quantum advantage. However, recent studies have shown that noise can severely limit the trainability of VQAs, e.g., by exponentially flattening the cost landscape and suppressing the magnitudes of cost gradients. Error Mitigation (EM) shows promise in reducing the impact of noise on near-term devices. Thus, it is natural to ask whether EM can improve the trainability of VQAs. In this work, we first show that, for a broad class of EM strategies, exponential cost concentration cannot be resolved without committing exponential resources elsewhere. This class of strategies includes as special cases Zero Noise Extrapolation, Virtual Distillation, Probabilistic Error Cancellation, and Clifford Data Regression. Second, we perform analytical and numerical analysis of these EM protocols, and we find that some of them (e.g., Virtual Distillation) can make it harder to resolve cost function values compared to running no EM at all. As a positive result, we do find numerical evidence that Clifford Data Regression (CDR) can aid the training process in certain settings where cost concentration is not too severe. Our results show that care should be taken in applying EM protocols as they can either worsen or not improve trainability. On the other hand, our positive results for CDR highlight the possibility of engineering error mitigation methods to improve trainability.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
NASA NTRS1972

Trace elements profiles, notably Hg, from a preliminary study of the Apollo 15 deep-drill core.

The possible thermal gradient near the surface during a lunation is considered together with the heat flow from the interior, the physical process of Hg migration, the results from core and trench samples from previous missions, and other temperature sensitive phenomena that may help understand the processes. U, Os, and Ru concentrations in the deep drill core samples are of potential interest and are summarized in a table. The Os tends to parallel the Hg profile with depth.

Jovanovic, S.↗
NASA NTRS1990

Reflecting boundary conditions for graded p-n junctions

In a graded junction, the formalism for handling reflecting boundary conditions must be modified. Since a significant drift term is present, zero recombination velocity at the surface does not imply a zero excess carrier gradient but rather zero overall flux. A model for analyzing p-n junctions fabricated by implantation or diffusion is presented, assuming the dominant recombination mechanism in the graded region is Auger. The model enables optimization of diode design. By proper selection of parameters, mainly by reducing surface concentration or by increasing the steepness of the dopant profile, it is possible to drastically reduce the saturation current generated by the graded region.

Schacham, S. E.↗
NASA NTRS1985

Effect of stress concentrations in composite structures

Composite structures have found wide use in many engineering fields and a sound understanding of their response under load is important to their utilization. An experimental program is being carried out to gain a fundamental understanding of the failure mechanics of multilayered composite structures at GALCIT. As a part of this continuing study, the performance of laminated composite plates in the presence of a stress gradient and the failure of composite structures at points of thickness discontinuity is assessed. In particular, the questions of initiation of failure and its subsequent growth to complete failure of the structure are addressed.

Babcock, C. D.↗
DOE OSTI2020

Predicting Morphological Evolution during Coprecipitation of MnCO 3 Battery Cathode Precursors Using Multiscale Simulations Aided by Targeted Synthesis

The performance of lithium-ion batteries is intimately linked to both the structure and the morphology of the cathode material, which in turn is critically linked to the synthesis conditions. However, few studies focus on understanding synthesis, especially during the coprecipitation of metal oxide precursors, a process that largely determines the final morphology of the material. In this paper, we go beyond the typical equilibrium particle shape analysis conducted in the literature and incorporate kinetic aspects of morphology evolution. We perform these studies using controlled synthesis on a well-defined metal salt system (MnCO 3 ) combined with multiscale simulations and high-resolution microscopy. Results show that with increasing metal concentration, the particles transition from rhombohedral to cubic to spherical shapes. Computational analysis using density functional theory (DFT) reveals that rhombohedral shaped particles evolve under equilibrium conditions. Phase field techniques indicate that at higher metal concentrations, fast growth kinetics of the precipitates result in the transition to cubic and, subsequently, spherical shapes, accompanied by a decrease in particle size. This study, while limited to the one metal salt system, provides an approach to shed light on the synthesis process of mixed transition metal salts, gradient materials, and other cathode materials of interest to the battery community.

25 ENERGY STORAGE↗
DOE OSTI2026

Understanding the Role of Extrinsic Impurities in Bulk Nb SRF Cavities

High gradient and high quality factor superconducting radiofrequency (SRF) cavities are essential for efficient particle acceleration in next-generation accelerators. This work demonstrates that the superconducting performance of bulk niobium can be enhanced through a controlled introduction of interstitial oxygen and nitrogen. Thermal and chemical surface treatments modify the concentration and distribution of these impurities, enabling systematic tuning of SRF cavity performance. By combining cavity RF measurements with quantitative materials characterizations, we isolate the impact of impurity concentration on BCS surface resistance and identify the mechanisms by which interstitial impurities alter the superconducting properties of niobium. We find that nitrogen is an order of magnitude more effective than oxygen in reducing BCS resistance at 16 MV/m and that the reduction arises from a combination of mean free path optimization and superconducting gap enhancement. Using these insights, we develop a predictive model that estimates cavity performance directly from room temperature sample material studies, reducing the reliance on full-scale cryogenic tests for surface treatment development. We then apply this model to explore co-doping strategies, demonstrating that combining interstitial oxygen and nitrogen achieves a synergistic reduction in BCS resistance. These results establish co-doping as a viable path for the development of surface-engineered niobium for future high quality factor SRF applications.

Hu, Hannah [Chicago U.]↗
DOE OSTI2020

Observations regarding inclusions in the growth of $\mathrm{Cs}$ 2 $\mathrm{HfCl}$ 6 single crystal scintillators

Cs 2 HfCl 6 (CHC) is a promising high density, high-Z, non-hygroscopic, and high energy resolution scintillator. In CHC, many crystals have CsCl inclusions that form during growth. In this paper, we investigate how material synthesis, growth rate, and thermal gradient affect the formation of CsCl inclusions and their effect on scintillation performance. First, precursor material was made through a methanol synthesis process both with and without hydrochlorination. Next, five crystals were grown using Bridgman method, at growth rates of 1 or 0.5 mm/h, and thermal gradients of 21 °C or 34 °C per millimeter. The best overall performance was observed in a 22 mm diameter crystal produced using hydrochlorination which was grown at 1 mm/h in a thermal gradient of 34 °C per millimeter. It had a light yield of 36,000 photons/MeV and an energy resolution of 4.0% at 662 keV. Finally, we have also shown that poorer scintillation performance in the lower quality crystals is most likely due to reduced light collection caused by a higher concentration of inclusions.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Reaction–Diffusion Coupling Facilitates the Sequential Precipitation of Metal Ions from Battery Feedstock Solutions

Here, the development of new technologies for chemical separations is urgently needed to meet the surging demand for critical materials that has strained resources and caused environmental challenges. Inspired by the classic Liesegang experiment, we demonstrated the separation of critical metal ions based on the coupling of ion diffusion and precipitation kinetics. For this purpose, a model feedstock solution simulating dissolved battery electrodes was placed on top of a hydrogel loaded with a precipitating agent, namely sodium hydroxide. As the lithium, manganese, cobalt, and nickel ions diffused into the gel, a gradient of precipitates formed along the length of the reactor. Elemental analysis of the spatially distributed precipitates showed the enrichment of nickel near the gel-solution interface, followed by the formation of an almost pure (>96%) manganese product further along the reactor. Optimization experiments revealed that a sodium hydroxide concentration of 10 mM and a gel/solution volume ratio of 2:1 favored efficient separations. The robustness of the method was demonstrated in four out of five feedstock compositions of typically used battery cathodes. Our proof-of-concept experiments present a paradigm for critical materials separations that does not require specialty chemicals, binding agents, membranes, or toxic solvents.

25 ENERGY STORAGE↗
NASA NTRS1980

Investigation of blown boundary layers with an improved wall jet system

Measurements were made in a two dimensional incompressible wall jet submerged under a thick upstream boundary layer with a zero pressure gradient and an adverse pressure gradient. The measurements included mean velocity and Reynolds stresses profiles, skin friction, and turbulence spectra. The measurements were confined to practical ratios (less than 2) of the jet velocity to the free stream velocity. The wall jet used in the experiments had an asymmetric velocity profile with a relatively higher concentration of momentum away from the wall. An asymmetric jet velocity profile has distinct advantages over a uniform jet velocity profile, especially in the control of separation. Predictions were made using Irwin's (1974) method for blown boundary layers. The predictions clearly show the difference in flow development between an asymmetric jet velocity profile and a uniform jet velocity profile.

Saripalli, K. R.↗
NASA NTRS1980

Advanced methods for preparation and characterization of infrared detector materials

Mercury cadmium telluride crystals were prepared by the Bridgman method with a wide range of crystal growth rates and temperature gradients adequate to prevent constitutional supercooling under diffusion-limited, steady state, growth conditions. The longitudinal compositional gradients for different growth conditions and alloy compositions were calculated and compared with experimental data to develop a quantitative model of the crystal growth kinetics for the Hg(i-x)CdxTe alloys, and measurements were performed to ascertain the effect of growth conditions on radial compositional gradients. The pseudobinary HgTe-CdTe constitutional phase diagram was determined by precision differential thermal analysis measurements and used to calculate the segregation coefficient of Cd as a function of x and interface temperature. Computer algorithms specific to Hg(1-x)CdxTe were developed for calculations of the charge carrier concentrations, charge carrier mobilities, Hall coefficient, optical absorptance, and Fermi energy as functions of x, temperature, ionized donor and acceptor concentrations, and neutral defect concentrations.

Lehoczky, S. L.↗
DOE OSTI2022

A parallel discrete dislocation dynamics/kinetic Monte Carlo method to study non-conservative plastic processes

Non-conservative processes play a fundamental role in plasticity and are behind important macroscopic phenomena such as creep, dynamic strain aging, loop raft formation, etc. In the most general case, vacancy-induced dislocation climb is the operating unit mechanism. While dislocation/vacancy interactions have been modeled in the literature using a variety of methods, the approaches developed rely on continuum descriptions of both the vacancy population and its fluxes. However, there are numerous situations in physics where point defect populations display heterogeneous concentrations and/or non-smooth kinetics. Here, a kinetic Monte Carlo (kMC) approach for modeling vacancy transport in response to arbitrary stress fields is used. Vacancies are treated as point particles and are coupled to the dislocation substructure representing a deformed material via an advection term defined by the local stress gradients. The stress fields and the dislocation substructure are evolved using a discrete dislocation dynamics (DDD) module. To extend the coupled model to the treatment of large systems, we have implemented it in the massively-parallel DDD code ParaDiS. To avoid numerical incompatibilities associated with merging deterministic (DDD) and stochastic (kMC) integration algorithms, we cast the entire elasto-plastic-diffusive problem within a single stochastic framework, taking advantage of a parallel kMC algorithm to evolve the system as a single event-driven process. The large-scale implementation enables the study of the evolution of a variety of dislocation-defect scenarios governed by non-conservative transport kinetics. After carrying out an exhaustive numerical and computational analysis of our parallel algorithm, we show results that emphasize situations where inhomogeneous vacancy dynamics are of relevance, and compare discrete kinetics to continuum solutions for several cases.

36 MATERIALS SCIENCE↗
DOE OSTI2020

2020 State of the Science Report, Chapter 7: Changes in Oceanographic Systems Associated with Marine Renewable Energy Devices

Oceanographic processes define the marine environment: the flow of water determines the concentrations of dissolved gases and nutrients, transports sediments, and maintains the habitats and water quality that support marine organisms and healthy ecosystems. Important physical processes in the ocean include, but are not limited to, tidal circulation and basin flushing, wave action, local and basin-scale ocean currents, temperature and salinity gradients, sediment transport forming and shaping coastlines, and the exchange of heat and dissolved gases at the air-water interface. Harnessing energy with marine renewable energy (MRE) devices has the potential to affect these processes in both the nearfield (within a few device lengths) and the farfield (farther from the device, from the scale of multiple devices to the scale of an enclosed basin) by removing energy from the system, changing natural flow patterns around devices, and/or decreasing wave heights. https://tethys.pnnl.gov/publications/state-of-the-science-2020-chapter-7-oceanographic-systems

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Vertical Characterization of Flow and Contaminant Concentration in New Hanford Extraction Wells

Effective groundwater remediation should focus on high-concentration, low-permeability zones within the aquifer, as these areas often present significant challenges to contaminant removal. Characterizing the vertical distribution of contamination in an aquifer is therefore critical for optimizing and monitoring pump-and-treat (P&T) systems to meet target cleanup timelines. Flow patterns driven by hydraulic gradients and variations in permeability are described to provide insight into contaminant mass removal from long-screened wells. The objective of this multi-phase work is to provide actionable recommendations for improving remedy performance monitoring and P&T operations, which ongoing evaluations will address. This report summarizes the preliminary results of vertical flow and contaminant distribution monitoring in new extraction wells at the Hanford Site.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Local-thermal-gradient and large-scale-circulation impacts on turbine-height wind speed forecasting over the Columbia River Basin

Abstract. We investigate the sensitivity of turbine-height wind speed forecast to initial condition (IC) uncertainties over the Columbia River Gorge (CRG) and Columbia River Basin (CRB) for two typical weather phenomena, i.e., local-thermal-gradient-induced marine air intrusion and a cold frontal passage. Four types of turbine-height wind forecast anomalies and their associated IC uncertainties related to local thermal gradients and large-scale circulations are identified using the self-organizing map (SOM) technique. The four SOM types are categorized into two patterns, each accounting for half of the ensemble members. The first pattern corresponds to IC uncertainties that alter the wind forecast through a modulating weather system, which produces the strongest wind anomalies in the CRG and CRB. In the second pattern, the moderate uncertainties in local thermal gradient and large-scale circulation jointly contribute to wind forecast anomaly. We analyze the cross section of wind and temperature anomalies through the gorge to explore the evolution of vertical features of each SOM type. The turbine-height wind anomalies induced by large-scale IC uncertainties are more concentrated near the front. In contrast, turbine-height wind anomalies induced by the local IC thermal uncertainties are found above the surface thermal anomalies. Moreover, the wind forecast accuracy in the CRG and CRB is limited by IC uncertainties in a few specific regions, e.g., the 2 m temperature within the basin and large-scale circulation over the northeast Pacific around 140∘ W.

17 WIND ENERGY↗
NASA NTRS1978

Fractional crystallization of iron meteorites, an experimental study

Measurements of the distribution coefficients of various elements (Ni, Co, P, Pt, Ir, Ge, Cr, and Au) between solid and liquid phases were made for FeNi alloys. A high thermal gradient crystal growing furnace was employed in order to promote plane front solidification, rapid mixing in the liquid and a minimum of diffusion in the solid. Eight measurements of the nickel distribution coefficient gave an average value of 0.91 plus or minus 0.03 and this value was independent of the Ni concentration in the range 5.5 to 8.75 wt. % Ni. Equilibrium distribution coefficients were also calculated by correcting for the diffusion boundary layer present in the liquid. These values are within 20% of the measured distribution coefficient values. Except for Co and Ni, all the measured distribution coefficient values are closer to 1.0 than those calculated by Scott (1972) for the IIIAB irons. Using the experimental values and the calculated equilibrium values for ternary additions to FeNi melts, it appears that fractional crystallization processes will not explain the observed chemical variations in the major iron meteorite groups. Alternative explanations are suggested which also recognize the fact that cooling rates vary widely in several chemical groups.

Goldstein, J. I.↗
NASA NTRS1989

Comparisons of satellite ozone data in the lower stratosphere for 1978/1979

Lower stratospheric zonal mean O3 distributions are compared in both hemispheres from the Nimbus 7 Solar Backscattered Ultraviolet (SBUV) and Limb Infrared Monitor of the Stratosphere (LIMS) data sets. Generally there is very good agreement with regard to individual profile shape and magnitude and with their longitudinal variability about the zonal mean. When the data are considered in terms of Umkehr layer amounts, there are subtle but significant differences in the respective meridional O3 gradients and their variations with time which are probably related to a changing O3 optical depth and constants to an assumed profile climatology in the retrieval. Stratospheric Aerosol and Gas Experiment (SAGE) satellite O3 results are presented which tend to split the differences between SBUV and LIMS. Additional comparisons with electrochemical concentration cell sonde and Mastsonde O3 profiles are presented in order to sort out the more noticeable differences.

Remsberg, Ellis E.↗