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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 1,045 records · Page 58
All sourcesNASA NTRSDOE OSTI
DOE OSTI2012

Coherent femtosecond low-energy single-electron pulses for time-resolved diffraction and imaging: A numerical study

We numerically investigate the properties of coherent femtosecond single electron wave packets photoemitted from nanotips in view of their application in ultrafast electron diffraction and non-destructive imaging with low-energy electrons. For two different geometries, we analyze the temporal and spatial broadening during propagation from the needle emitter to an anode, identifying the experimental parameters and challenges for realizing femtosecond time resolution. The simple tip-anode geometry is most versatile and allows for electron pulses of several ten of femtosecond duration using a very compact experimental design, however, providing very limited control over the electron beam collimation. A more sophisticated geometry comprising a suppressor-extractor electrostatic unit and a lens, similar to typical field emission electron microscope optics, is also investigated, allowing full control over the beam parameters. Using such a design, we find {approx}230 fs pulses feasible in a focused electron beam. The main limitation to achieve sub-hundred femtosecond time resolution is the typical size of such a device, and we suggest the implementation of more compact electron optics for optimal performance.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2013

Controlled nanostructuration of polycrystalline tungsten thin films

Nanostructured tungsten thin films have been obtained by ion beam sputtering technique stopping periodically the growing. The total thickness was maintained constant while nanostructure control was obtained using different stopping periods in order to induce film stratification. The effect of tungsten sublayers' thicknesses on film composition, residual stresses, and crystalline texture evolution has been established. Our study reveals that tungsten crystallizes in both stable {alpha}- and metastable {beta}-phases and that volume proportions evolve with deposited sublayers' thicknesses. {alpha}-W phase shows original fiber texture development with two major preferential crystallographic orientations, namely, {alpha}-W<110> and unexpectedly {alpha}-W<111> texture components. The partial pressure of oxygen and presence of carbon have been identified as critical parameters for the growth of metastable {beta}-W phase. Moreover, the texture development of {alpha}-W phase with two texture components is shown to be the result of a competition between crystallographic planes energy minimization and crystallographic orientation channeling effect maximization. Controlled grain size can be achieved for the {alpha}-W phase structure over 3 nm stratification step. Below, the {beta}-W phase structure becomes predominant.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2014

Hydrogen at zinc vacancy of ZnO: An EPR and ESEEM study

An electron paramagnetic resonance (EPR) spectrum, labeled S1, with small-splitting doublet accompanied by weak satellites is observed in ZnO irradiated with 2 MeV electrons. The obtained structure is shown to be the hyperfine structure due to the dipolar interaction between an unpaired electron spin and a nuclear spin of hydrogen (H). The observation of the nuclear Zeeman frequency of H in electron spin echo envelope modulation experiments further confirmed the presence of a hydrogen atom in S1. From the observed spin-Hamiltonian parameters, S1 is identified to be the partly H-passivated Zn vacancy, V{sub Zn}{sup −}H{sup +}, with the H{sup +} ion making a short O-H bond with only one nearest O neighbor of V{sub Zn} in the basal plane, being off the substitutional site, while the unpaired electron spin, which gives rise to the observed EPR signal, is localized on the p orbital of another O neighbor also in the basal plane.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2014

Modelling morphology evolution during solidification of IPP in processing conditions

During polymer processing, crystallization takes place during or soon after flow. In most of cases, the flow field dramatically influences both the crystallization kinetics and the crystal morphology. On their turn, crystallinity and morphology affect product properties. Consequently, in the last decade, researchers tried to identify the main parameters determining crystallinity and morphology evolution during solidification In processing conditions. In this work, we present an approach to model flow-induced crystallization with the aim of predicting the morphology after processing. The approach is based on: interpretation of the FIC as the effect of molecular stretch on the thermodynamic crystallization temperature; modeling the molecular stretch evolution by means of a model simple and easy to be implemented in polymer processing simulation codes; identification of the effect of flow on nucleation density and spherulites growth rate by means of simple experiments; determination of the condition under which fibers form instead of spherulites. Model predictions reproduce most of the features of final morphology observed in the samples after solidification.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Spin-Hall nano-oscillator: A micromagnetic study

This Letter studies the dynamical behavior of spin-Hall nanoscillators from a micromagnetic point of view. The model parameters have been identified by reproducing recent experimental data quantitatively. Our results indicate that a strongly localized mode is observed for in-plane bias fields such as in the experiments, while predict the excitation of an asymmetric propagating mode for large enough out-of plane bias field similarly to what observed in spin-torque nanocontact oscillators. Our findings show that spin-Hall nanoscillators can find application as spin-wave emitters for magnonic applications where spin waves are used for transmission and processing information on nanoscale.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2014

Reduction of scattering using thin all-dielectric shells designed by stochastic optimizer

Adaptive differential evolution method has been used for optimization of all-dielectric multilayer coatings in order to reduce total scattering from spherical targets. The optimal refractive index profiles have been found for various sizes of targets and thicknesses of coatings. Few profile types that appear to be optimal for various geometrical parameters have been identified. Scattering of the target with diameter of 0.75 λ has been reduced by 85% using 0.16 λ thick coating formed by isotropic dielectric materials. For larger targets, scattering reduction becomes smaller, but it still reaches 50% for targets with the diameter of 1.5 λ. The obtained designs provide a route to implement cloaking without the use of magnetic and anisotropic metamaterials.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2014

Numerical tailoring of linear response from plasmonic nano-resonators grown on a layer of polystyrene spheres

We developed a geometrical method to reproduce the morphology of hybrid structures composed by self-ordered dielectric nanospheres covered by anisotropic plasmonic structures. Numerical analysis allowed to investigate the optical response of the considered system, and to identify the relevant parameters to achieve efficient and versatile light manipulation. In particular, we show that the overall structure, acting as a hybrid plasmonic-photonics meta-surface, can be engineered in order to maximize its linear and circular dichroic behavior at optical frequencies.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2014

A model for arsenic anti-site incorporation in GaAs grown by hydride vapor phase epitaxy

GaAs growth by hydride vapor phase epitaxy (HVPE) has regained interest as a potential route to low cost, high efficiency thin film photovoltaics. In order to attain the highest efficiencies, deep level defect incorporation in these materials must be understood and controlled. The arsenic anti-site defect, As{sub Ga} or EL2, is the predominant deep level defect in HVPE-grown GaAs. In the present study, the relationships between HVPE growth conditions and incorporation of EL2 in GaAs epilayers were determined. Epitaxial n-GaAs layers were grown under a wide range of deposition temperatures (T{sub D}) and gallium chloride partial pressures (P{sub GaCl}), and the EL2 concentration, [EL2], was determined by deep level transient spectroscopy. [EL2] agreed with equilibrium thermodynamic predictions in layers grown under conditions in which the growth rate, R{sub G}, was controlled by conditions near thermodynamic equilibrium. [EL2] fell below equilibrium levels when R{sub G} was controlled by surface kinetic processes, with the disparity increasing as R{sub G} decreased. The surface chemical composition during growth was determined to have a strong influence on EL2 incorporation. Under thermodynamically limited growth conditions, e.g., high T{sub D} and/or low P{sub GaCl}, the surface vacancy concentration was high and the bulk crystal was close to equilibrium with the vapor phase. Under kinetically limited growth conditions, e.g., low T{sub D} and/or high P{sub GaCl}, the surface attained a high GaCl coverage, blocking As adsorption. This competitive adsorption process reduced the growth rate and also limited the amount of arsenic that incorporated as As{sub Ga}. A defect incorporation model which accounted for the surface concentration of arsenic as a function of the growth conditions, was developed. This model was used to identify optimal growth parameters for the growth of thin films for photovoltaics, conditions in which a high growth rate and low [EL2] could be attained.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2015

Polarization-dependent diffraction in all-dielectric, twisted-band structures

We propose a concept for light polarization management: polarization-dependent diffraction in all-dielectric microstructures. Numerical simulations of light propagation show that with an appropriately configured array of twisted bands, such structures may exhibit zero birefringence and at the same time diffract two circular polarizations with different efficiencies. Non-birefringent structures as thin as 3 μm have a significant difference in diffraction efficiency for left- and right-hand circular polarizations. We identify the structural parameters of such twisted-band matrices for optimum performance as circular polarizers.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2016

Wetting of a partially immersed compliant rod

The force on a solid rod partially immersed in a liquid is commonly used to determine the liquid-vapor surface tension by equating the measured force required to remove the rod from the liquid to the vertical component of the liquid-vapor surface tension. Here, we study how this process is affected when the rod is compliant. For equilibrium, we enforce force and configurational energy balance, including contributions from elastic energy. We show that, in general, the contact angle does not equal that given by Young's equation. If surface stresses are tensile, the strain in the immersed part of the rod is found to be compressive and to depend only on the solid-liquid surface stress. The strain in the dry part of the rod can be either tensile or compressive, depending on a combination of parameters that we identify. We provide results for compliant plates partially immersed in a liquid under plane strain and plane stress. Our results can also be used to extract solid surface stresses from such experiments.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Charged particle reflection by a planar artificially structured boundary with electrostatic plugging

A classical trajectory Monte Carlo simulation is used to investigate an artificially structured boundary for confinement and control of charged particles. The artificially structured boundary considered here incorporates a planar sequence of conducting wires, where adjacent wires carry current in opposite directions. Such a configuration creates a sequence of magnetic cusps and was studied previously [C. A. Ordonez, J. Appl. Phys. 106, 024905 (2009)]. The effect of introducing a sequence of electrodes for electrostatic plugging of the cusps is investigated. The results of the simulations are used to identify regions of parameter space in which particle losses through the cusps may be negligible in the single particle limit. A trap based on a cylindrical generalization of the artificially structured boundary presented here may lead to a method for confining non-neutral and partially neutralized plasmas along the edge, such that the bulk of a confined plasma is effectively free of externally applied electromagnetic fields.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2022

Toward fully coherent soft x-ray free-electron laser via echo-enabled harmonic generation in fourth generation synchrotron light sources

Having previously reported on bunching via echo-enabled harmonic generation (EEHG) as an effective way to improve the longitudinal coherence in the NSLS-II storage ring [X. Yang et al., Sci. Rep. 12, 9437 (2022)], we demonstrate that this EEHG scheme can be easily adopted to any fourth generation diffraction-limited synchrotron light source with significant benefits. The advantage of the scheme is that it requires no change of the lattice and is fully compatible with other beamlines. Since the EEHG performance is mainly determined by the momentum compaction, beam emittances, and beta functions of a SR lattice, we have identified these crucial parameters and successfully built a generalized model, which can predict the performance of nearly any SLS. Regarding the fourth generation SLSs, momentum compactions are often significantly smaller; thus, to cover the x rays with a photon energy of up to 1 keV, we utilize a specific design, including a 250 nm seed-laser wavelength. Our model predicts that for most of the current and future fourth generation SLSs, the EEHG scheme can produce significant prebunching up to harmonic 200 and, thus, generate a few MW scale peak power at 1.25 nm wavelength.

47 OTHER INSTRUMENTATION↗
DOE OSTI2023

Bottom-up synthesis of mesoscale nanomeshes of graphene nanoribbons on germanium

The synthesis of functional graphene nanostructures on Ge(001) provides an attractive route toward integrating graphene-based electronic devices onto complementary metal oxide semiconductor-compatible platforms. In this study, we leverage the phenomenon of the anisotropic growth of graphene nanoribbons from rationally placed graphene nanoseeds and their rotational self-alignment during chemical vapor deposition to synthesize mesoscale graphene nanomeshes over areas spanning several hundred square micrometers. Lithographically patterned nanoseeds are defined on a Ge(001) surface at pitches ranging from 50 to 100 nm, which serve as starting sites for subsequent nanoribbon growth. Rotational self-alignment of the nanoseeds followed by anisotropic growth kinetics causes the resulting nanoribbons to be oriented along each of the equivalent, orthogonal Ge < 110 > directions with equal probability. As the nanoribbons grow, they fuse, creating a continuous nanomesh. In contrast to nanomesh synthesis via top-down approaches, this technique yields nanomeshes with atomically faceted edges and covalently bonded junctions, which are important for maximizing charge transport properties. Additionally, we simulate the electrical characteristics of nanomeshes synthesized from different initial nanoseed-sizes, size-polydispersities, pitches, and device channel lengths to identify a parameter-space for acceptable on/off ratios and on-conductance in semiconductor electronics. The simulations show that decreasing seed diameter and pitch are critical to increasing nanomesh on/off ratio and on-conductance, respectively. With further refinements in lithography, nanomeshes obtained via seeded synthesis and anisotropic growth are likely to have superior electronic properties with tremendous potential in a multitude of applications, such as radio frequency communications, sensing, thin-film electronics, and plasmonics.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2025

Injection locking and coupling dynamics in superconducting nanowire-based cryogenic oscillators

Oscillators designed to function at cryogenic temperatures play a critical role in superconducting electronics and quantum computing by providing stable, low-noise signals with minimal energy loss. Here, in this work, we present a comprehensive numerical study of injection locking and mutual coupling dynamics in superconducting nanowire (ScNW)-based cryogenic oscillators. Using the design space of a standalone ScNW-based oscillator, we investigate two critical mechanisms that govern frequency synchronization and signal coordination in cryogenic computing architectures: (1) injection locking induced by an external AC signal with a frequency near the oscillator's natural frequency, and (2) the mutual coupling dynamics between two ScNW oscillators under varying coupling strengths. We identify key design parameters—such as shunt resistance, nanowire inductance, and coupling strength—that govern the locking range. Additionally, we examine how the amplitude of the injected signal affects the amplitude of the locked oscillation, offering valuable insights for power-aware oscillator synchronization. Furthermore, we analyze mutual synchronization between coupled ScNW oscillators using capacitive and resistive coupling elements. Our results reveal that the phase difference between oscillators can be controlled by tuning the coupling strength, enabling programmable phase-encoded information processing. These findings could enable building ScNW-based oscillatory neural networks, synchronized cryogenic logic blocks, and on-chip cryogenic resonator arrays.

Artificial neural networks↗
DOE OSTI2017

Transverse fields to tune an Ising-nematic quantum phase transition

Significance Many interesting materials, including various high-temperature superconductors, exhibit a low-temperature “electron nematic” phase in which the electronic properties spontaneously break the rotational symmetry of the crystal. A nematic quantum critical point (QCP) marks the zero-temperature phase transition from a nematic ground state to a symmetric state as a function of a macroscopic nonthermal parameter. Here, we examine appropriate general means to tune Ising nematic systems to a QCP and in particular show that shear strain is a powerful tuning parameter. Moreover, we identify 4f ferroquadrupolar order as a realization of Ising nematic order and argue that it provides a promising platform for fundamental studies of metallic QCPs in the laboratory.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Robust nonequilibrium pathways to microcompartment assembly

Significance The structure of the carboxysome resembles a viral capsid, but, unlike many viruses, the monomers of its shell do not appear to fit together in a uniquely preferred way. As a result, the size and shape of this bacterial microcompartment must be determined by the dynamics of its self-assembly process. Using theory and simulation of a model system, we show that the mechanism of assembling such a structure can proceed through nonequilibrium dynamics that are both reliable and controllable. We identify experimentally tunable parameters that modulate the shape and size of the assembled structure, advancing strategies to repurpose natural microcompartments and to create synthetic mimics.

Rotskoff, Grant M.↗
DOE OSTI2013

METAL ABUNDANCES OF 12 DWARF IRREGULARS FROM THE ADBS SURVEY

We have analyzed long-slit spectra of 12 dwarf irregular galaxies from the Arecibo Dual Beam Survey (ADBS). These galaxies represent a heterogeneous sample of objects detected by ADBS, but on average are relatively gas-rich, low-surface-brightness, and low-mass, thus represent a region of the galaxian population that is not commonly included in optical surveys. The metallicity-luminosity relationship for these galaxies is analyzed; the galaxies discussed in this paper appear to be under-abundant at a given luminosity when compared to a sample from the literature. We attempt to identify a 'second parameter' responsible for the intrinsic scatter and apparent under-abundance of our galaxies. We do not find a definitive second parameter but note the possible indication that infall or mixing of pristine gas may be responsible. We derive oxygen abundances for multiple H II regions in many of our galaxies but do not find any strong indications of metallicity variation within the galaxies except in one case where we see variation between an isolated H II region and the rest of the galaxy. Our data set includes the galaxy with the largest known H I-to-optical size ratio, ADBS 113845+2008. Our abundance analysis of this galaxy reveals that it is strongly over-enriched compared to galaxies of similar luminosity, indicating it is not a young object and confirming the result from Cannon et al. that this galaxy appears to be intrinsically rare in the local universe.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2014

Characterizing the convective velocity fields in massive stars

We apply the mathematical formalism of vector spherical harmonics decomposition to convective stellar velocity fields from multidimensional hydrodynamics simulations and show that the resulting power spectra furnish a robust and stable statistical description of stellar convective turbulence. Analysis of the power spectra helps identify key physical parameters of the convective process such as the dominant scale of the turbulent motions that influence the structure of massive evolved pre-supernova stars. We introduce the numerical method that can be used to calculate vector spherical harmonics power spectra from two-dimensional (2D) and three-dimensional (3D) convective shell simulation data. Using this method we study the properties of oxygen shell burning and convection for a 15 M {sub ☉} star simulated by the hydrodynamics code FLASH in 2D and 3D. We discuss the importance of realistic initial conditions to achieving successful core-collapse supernova explosions in multidimensional simulations. We show that the calculated power spectra can be used to generate realizations of the velocity fields of presupernova convective shells. We find that the slope of the solenoidal mode power spectrum remains mostly constant throughout the evolution of convection in the oxygen shell in both 2D and 3D simulations. We also find that the characteristic radial scales of the convective elements are smaller in 3D than in 2D, while the angular scales are larger in 3D.

79 ASTRONOMY AND ASTROPHYSICS↗