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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 1,135 records · Page 63
All sourcesNASA NTRSDOE OSTI
NASA NTRS2006

Slat Cove Unsteadiness Effect of 3D Flow Structures

Previous studies have indicated that 2D, time accurate computations based on a pseudo-laminar zonal model of the slat cove region (within the framework of the Reynolds-Averaged Navier-Stokes equations) are inadequate for predicting the full unsteady dynamics of the slat cove flow field. Even though such computations could capture the large-scale, unsteady vorticity structures in the slat cove region without requiring any external forcing, the simulated vortices were excessively strong and the recirculation zone was unduly energetic in comparison with the PIV measurements for a generic high-lift configuration. To resolve this discrepancy and to help enable physics based predictions of slat aeroacoustics, the present paper is focused on 3D simulations of the slat cove flow over a computational domain of limited spanwise extent. Maintaining the pseudo-laminar approach, current results indicate that accounting for the three-dimensionality of flow fluctuations leads to considerable improvement in the accuracy of the unsteady, nearfield solution. Analysis of simulation data points to the likely significance of turbulent fluctuations near the reattachment region toward the generation of broadband slat noise. The computed acoustic characteristics (in terms of the frequency spectrum and spatial distribution) within short distances from the slat resemble the previously reported, subscale measurements of slat noise.

Choudhari, Meelan M.↗
NASA NTRS2012

Possible Detection of an Emission Cyclotron Resonance Scattering Feature from the Accretion-Powered Pulsar 4U 1626-67

We present analysis of 4U 1626-67, a 7.7 s pulsar in a low-mass X-ray binary system, observed with the hard X-ray detector of the Japanese X-ray satellite Suzaku in 2006 March for a net exposure of ~88 ks. The source was detected at an average 10-60 keY flux of approx 4 x 10-10 erg / sq cm/ s. The phase-averaged spectrum is reproduced well by combining a negative and positive power-law times exponential cutoff (NPEX) model modified at approx 37 keY by a cyclotron resonance scattering feature (CRSF). The phase-resolved analysis shows that the spectra at the bright phases are well fit by the NPEX with CRSF model. On the other hand. the spectrum in the dim phase lacks the NPEX high-energy cutoff component, and the CRSF can be reproduced by either an emission or an absorption profile. When fitting the dim phase spectrum with the NPEX plus Gaussian model. we find that the feature is better described in terms of an emission rather than an absorption profile. The statistical significance of this result, evaluated by means of an F test, is between 2.91 x 10(exp -3) and 1.53 x 10(exp -5), taking into account the systematic errors in the background evaluation of HXD-PIN. We find that the emission profile is more feasible than the absorption one for comparing the physical parameters in other phases. Therefore, we have possibly detected an emission line at the cyclotron resonance energy in the dim phase.

Iwakiri, W. B.↗
DOE OSTI2013

Bayesian calibration of reactor neutron flux spectrum using activation detectors measurements: Application to CALIBAN reactor

In this paper, we present calibration methods in order to estimate reactor neutron flux spectrum and its uncertainties by using integral activation measurements. These techniques are performed using Bayesian and MCMC framework. These methods are applied to integral activation experiments in the cavity of the CALIBAN reactor. We estimate the neutron flux and its related uncertainties. The originality of this work is that these uncertainties take into account measurements uncertainties, cross-sections uncertainties and model error. In particular, our results give a very good approximation of the total flux and indicate that neutron flux from MCNP simulation for energies above about 5 MeV seems to overestimate the 'real flux'. (authors)

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2014

The contribution of microbunching instability to solar flare emission in the GHz to THz range of frequencies

Recent solar flare observations in the sub-terahertz range have provided evidence of a new spectral component with fluxes increasing for larger frequencies, separated from the well-known microwave emission that maximizes in the gigahertz range. Suggested interpretations explain the terahertz spectral component but do not account for the simultaneous microwave component. We present a mechanism for producing the observed 'double spectra'. Based on coherent enhancement of synchrotron emission at long wavelengths in laboratory accelerators, we consider how similar processes may occur within a solar flare. The instability known as microbunching arises from perturbations that produce electron beam density modulations, giving rise to broadband coherent synchrotron emission at wavelengths comparable to the characteristic size of the microbunch structure. The spectral intensity of this coherent synchrotron radiation (CSR) can far exceed that of the incoherent synchrotron radiation (ISR), which peaks at a higher frequency, thus producing a double-peaked spectrum. Successful CSR simulations are shown to fit actual burst spectral observations, using typical flaring physical parameters and power-law energy distributions for the accelerated electrons. The simulations consider an energy threshold below which microbunching is not possible because of Coulomb repulsion. Only a small fraction of the radiating charges accelerated to energies above the threshold is required to produce the microwave component observed for several events. The ISR/CSR mechanism can occur together with other emission processes producing the microwave component. It may bring an important contribution to microwaves, at least for certain events where physical conditions for the occurrence of the ISR/CSR microbunching mechanism are possible.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2017

Statistics of Point Vortex Turbulence in Non-neutral Flows and in Flows with Translational and Rotational Symmetries

A theory (Esler and Ashbee in J Fluid Mech 779:275–308, 2015) describing the statistics of N freely-evolving point vortices in a bounded two-dimensional domain is extended. First, the case of a non-neutral vortex gas is addressed, and it is shown that the density of states function can be identified with the probability density function of an infinite sum of independent non-central chi-squared random variables, the details of which depend only on the shape of the domain. Equations for the equilibrium energy spectrum and other statistical quantities follow, the validity of which are verified against direct numerical simulations of the equations of motion. Second, domains with additional conserved quantities associated with a symmetry (e.g., circle, periodic channel) are investigated, and it is shown that the treatment of the non-neutral case can be modified to account for the additional constraint.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

Field evolution of magnons in α - RuCl 3 by high-resolution polarized terahertz spectroscopy

Here, the Kitaev quantum spin liquid (KSL) is a theoretically predicted state of matter whose fractionalized quasiparticles are distinct from bosonic magnons, the fundamental excitation in ordered magnets. The layered honeycomb antiferromagnet α–RuCl 3 is a KSL candidate material, as it can be driven to a magnetically disordered phase by application of an in-plane magnetic field, with H c ~ 7 T. Here, we report a detailed characterization of the magnetic excitation spectrum of this material by high-resolution time-domain terahertz spectroscopy. We observe two sharp magnon resonances whose frequencies and amplitudes exhibit a discontinuity as a function of applied magnetic field, as well as two broader peaks at higher energy. Below the Néel temperature, we find that linear spin wave theory can account for all of these essential features of the spectra when a C 3 -breaking distortion of the honeycomb lattice and the presence of structural domains are taken into account.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Spin cutoff factor and level density for Ni 59 from an analysis of compound nuclear reactions

The spin cutoff parameter for 59 Ni has been studied from different types of experimental data, including neutron angular distributions from the 56 Fe(α,n) 59 Ni reaction, spin of discrete levels, the level density from the proton evaporation spectrum of the 54 Fe( 6 Li,p) 59 Ni reaction and neutron resonance spacing. Experimental data points were compared with calculations using models widely used in literature. It was found that the available empirical models overestimate data points in the energy region below the neutron separation energy, while microscopic calculations which take into account pairing correlations within Hartree-Fock +Bardeen-Cooper-Schrieffer approach are consistent with data. As a result, it confirmed earlier findings that pairing correlations play an important role and need to be taken into account when the spin cutoff parameter is calculated below the neutron separation energy.

(a,n) reaction↗
DOE OSTI2018

The Influence of Copper Impurity on the Electronic Structure and Optical Properties of TmNi{sub 5} Compound

Investigations of the electronic structure and optical properties of TmNi{sub 5–х}Сu{sub x} (х = 0, 1, 2, 3) compounds were performed. Self-consistent calculations of the band spectrum have been performed in the local electron-spin-density approximation with a correction on strong electron interactions within the LSDA + U method. Total and partial densities of electron states associated with thulium, nickel, and copper atoms have been calculated. Optical conductivity, the behavior of which is interpreted for each compound taking into account the performed calculations, has been measured by the ellipsometry method in a wide wavelength range of 0.22–16 μm. Concentration dependences of plasma and relaxation frequencies of conduction electrons have been determined.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

An Economics-by-Design Approach Applied to a Heat Pipe Microreactor Concept

Microreactors present a potential paradigm shift in the nuclear industry. Emphasis thus far has been on large-scale multi-billion-dollar projects that cater solely to grid electricity market. These projects can be challenging to finance and execute. On the other hand, microreactors are intended to target a wide variety of smaller niche markets and are expected to be factory-fabricated and more readily deployable. While diseconomies of scale for microreactors may tend to raise their costs per energy output (MWh) relative to large nuclear plants, offsetting gains can be expected from standardization, simplification, passive safety, lower radionuclide inventories, factory fabrication, fast installation, and low financing costs. To adequately assess these contributions, designers should have a different perspective on cost drivers than for large nuclear plants and can utilize novel approaches for systematic cost reduction. To account for these important aspects of microreactors, this report proposes an economics-by-design approach that places economic considerations at the center of the design process. The methodology builds on existing frameworks such as design-to-cost and value engineering, expanding them to new markets (beyond the grid), new attributes (beyond costs alone), and introducing the approach at earlier points in the design cycle. Design parameters and technical specifications are systematically evaluated until costs meet market entry points, while also providing the high-priority performance attributes of the particular use case. Determining first-order estimates for different components early in the process enables designers to focus R&D efforts on the biggest overall cost contributors and components with the most cost uncertainty. The analysis is always guided by market needs and threshold prices. In addition to microreactors, the approach is expected to be useful for other classes of nuclear reactors as well. The analysis was applied to a concept found in the open literature (the Design A heat-pipe reactor). A comprehensive bottom-up estimate was generated by leveraging a new microreactor-specific code of accounts and a range of cost equations. The initial estimate for levelized cost of electricity (LCOE) unsurprisingly exceeded market ranges since the use case had prioritized technological readiness over economic considerations in design choices. An alternate concept was then proposed, with various assumptions/targets made to reduce the largest cost contributors. Changes in the neutron spectrum, the power output, and building structures were found to make even the first-of-a-kind of this modified concept competitive with diesel generation in some remote communities. Learning rate (LR) assumptions indicated cost reductions achieved from sequential unit deployments could expand the range of competitiveness to include additional markets as deployments proceed.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2021

ACCESS and LRG-BEASTS: A Precise New Optical Transmission Spectrum of the Ultrahot Jupiter WASP-103b

We present a new ground-based optical transmission spectrum of the ultrahot Jupiter WASP-103b (T{sub eq}=2484 K). Our transmission spectrum is the result of combining five new transits from the ACCESS survey and two new transits from the LRG-BEASTS survey with a reanalysis of three archival Gemini/GMOS transits and one VLT/FORS2 transit. Our combined 11-transit transmission spectrum covers a wavelength range of 3900–9450 Å with a median uncertainty in the transit depth of 148 parts per million, which is less than one atmospheric scale height of the planet. In our retrieval analysis of WASP-103b’s combined optical and infrared transmission spectrum, we find strong evidence for unocculted bright regions (4.3σ) and weak evidence for H{sub 2}O (1.9σ), HCN (1.7σ), and TiO (2.1σ), which could be responsible for WASP-103b’s observed temperature inversion. Our optical transmission spectrum shows significant structure that is in excellent agreement with the extensively studied ultrahot Jupiter WASP-121b, for which the presence of VO has been inferred. For WASP-103b, we find that VO can only provide a reasonable fit to the data if its abundance is implausibly high and we do not account for stellar activity. Our results highlight the precision that can be achieved by ground-based observations and the impacts that stellar activity from F-type stars can have on the interpretation of exoplanet transmission spectra.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1975

Fabrication and evaluation of polymeric early-warning fire-alarm devices

The electrical resistivities were investigated of some polymers known to be enhanced by the presence of certain gases. This was done to make a device capable of providing early warning to fire through its response with the gases produced in the early phases of combustion. Eight polymers were investigated: poly(phenyl acetylene), poly(p-aminophenyl acetylene), poly(p-nitrophenyl acetylene), poly(p-formamidophenyl acetylene), poly(ethynyl ferrocene), poly(ethynyl carborane), poly(ethynyl pyridine), and the polymer made from 1,2,3,6 tetramethyl pyridazine. A total of 40 usable thin-film sandwich devices and a total of 70 usable interdigitated-electrode lock-and-key devices were fabricated. The sandwich devices were used for measurements of contact linearity, polymer conductivity, and polymer dielectric constant. The lock-and-key devices were used to determine the response of the polymers to a spectrum of gases that included ammonia, carbon nonoxide, carbon dioxide, sulfur dioxide, ethylene, acrolein, water vapor, and normal laboratory air. Strongest responses were to water vapor, ammonia, and acrolein, and depending on the polymer, weaker responses to carbon dioxide, sulfur dioxide, and carbon monoxide were observed. A quantitative theory of device operation, capable of accounting for observed device leakage current and sensitivity, was developed. A prototype detection/alarm system was designed and built for use in demonstrating sensor performance.

Senturia, S. D.↗
NASA NTRS1991

Modeling the reflectance spectrum of Callisto 0.25 to 4.1 microns

Models employing Hapke's (1981) radiative transfer theory are presented for the 0.2-4.1 micron reflectance spectrum. A simultaneous intimate, as well as aereal, mixture solution of ice and dark material is envisioned, in order to satisfy both absorption band depths and reflectance levels. The models indicate that the surface's ice component is rather large-grained, and that the major spectral features above about 2.5 microns cannot be accounted for by the ice. Spectra obtained for the nonice material were similar to each other; their absorption features resemble hydrated silicates bearing both oxidation states of iron.

Calvin, Wendy M.↗
NASA NTRS1991

Compton backscattered 511 keV annihilation line emission and the 170 keV line from the Galactic center direction

It is shown that Compton scattering of 511 keV electron-positron annihilation radiation produces a linelike reflection feature at 170 keV from backscattered photons. Assuming simple models of clouds and accretion disks around a compact source, the paper explores the spectrum of Compton-scattered annihilation line emission for a range of geometries, opacities, and observing angles, and finds that the linelike feature is produced under a wide variety of conditions. It is further shown that such Compton backscattering of slightly redshifted annihilation line emission from the inner edge of an accretion disk could account for the 170 keV line emission and higher energy continuum observed together with the 511 keV annihilation radiation from the direction of the Galactic center. Identification of the observed 170 keV line as a slightly redshifted annihilation line reflection feature provides strong new evidence that the source of this emission is a compact object surrounded by a disk of presumably accreting matter.

Lingenfelter, Richard E.↗
DOE OSTI2013

Improvements of the boundary projection acceleration technique applied to the discrete-ordinates transport solver in XYZ geometries

In this paper we discuss the latest upgrades of the Boundary Projection Acceleration (BPA) applied to the XYZ transport solver of APOLLO3, namely IDT. The acceleration method is a well-known effective technique for the speed-up of the source iterations of the discrete-ordinates method. The BPA in IDT has been improved in three aspects: the taking into account of the residue on boundary conditions as a boundary source for the acceleration problem, the extension of the method to higher order angular moments in the case of anisotropic scattering and, finally, the application of the method to the multigroup iterations for the acceleration of the fission source and k-effective. The spectrum of the method has been Fourier-analyzed to explore the effectiveness. The 3D mock-up geometry of the ZPPR is presented as final study to test the performances of the acceleration on a realistic whole-core 3D calculation. (authors)

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2016

Conformation-specific spectroscopy of alkyl benzyl radicals: Effects of a radical center on the CH stretch infrared spectrum of an alkyl chain

An important initial step in the combustion of gasoline and diesel fuels is the abstraction of hydrogen from alkylbenzenes to form resonance-stabilized alkyl benzyl radicals. This work uses, for the first time, double resonance spectroscopy methods to explore the conformation-specific vibronic and infrared spectroscopy of the α-ethylbenzyl (αEtBz) and α-propylbenzyl (αPrBz) radicals. Local mode Hamiltonian modeling enables assignment of the alkyl CH stretch IR spectra, accounting for Fermi resonance that complicates aliphatic alkyl CH stretch IR spectroscopy. The ground state conformational preferences of the ethyl and propyl chains are changed from those in the alkylbenzenes themselves, with global minima occurring for an in-plane orientation of the alkyl chain (trans) about its first dihedral angle (Φ f123 , numbers are alkyl C atoms. C 1 is CH radical site). This in-plane structure is the only observed conformer for the α-EtBz radical, while two conformers, tt and tg' share this orientation at the first dihedral, but differ in the second (Φ 1234 ) for the αPrBz radical. The in-plane orientation lowers the local site frequencies of the CH 2 group stretches immediately adjacent to the benzylic radical site by about 50 cm -1 relative to those in pure alkyl chains or alkylbenzenes. This effect of the radical site is localized on the first CH 2 group, with little effect on subsequent members of the alkyl chain. In the D 1 excited electronic state, an out-of-plane orientation is preferred for the alkyl chains, leading to torsional mode Franck-Condon activity in the D 0 -D 1 spectra that is both conformer-specific and diagnostic of the conformational change.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Joint thrust and TMD resummation in electron-positron and electron-proton collisions

In this work, we present the framework for obtaining precise predictions for the transverse momentum of hadrons with respect to the thrust axis in e + e - collisions. This will enable a precise extraction of transverse momentum dependent (TMD) fragmentation functions from a recent measurement by the Belle Collaboration. Our analysis takes into account, for the first time, the nontrivial interplay between the hadron transverse momentum and the cut on the thrust event shape. To this end, we identify three different kinematic regions, derive the corresponding factorization theorems within Soft Collinear Effective Theory, and present all ingredients needed for the joint resummation of the transverse momentum and thrust spectrum at NNLL accuracy. One kinematic region can give rise to non-global logarithms (NGLs), and we describe how to include the leading NGLs. We also discuss alternative measurements in e + e - collisions that can be used to access the TMD fragmentation function. Finally, by using crossing symmetry, we obtain a new way to constrain TMD parton distributions, by measuring the displacement of the thrust axis in ep collisions.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2018

Unraveling electronic absorption spectra using nuclear quantum effects: Photoactive yellow protein and green fluorescent protein chromophores in water

Many physical phenomena must be accounted for to accurately model solution-phase optical spectra line shapes, from the sampling of chromophore-solvent configurations to the electronic-vibrational transitions leading to vibronic fine structure. Here we thoroughly explore the role of nuclear quantum effects, direct and indirect solvent effects, and vibronic effects in the computation of the optical spectrum of the aqueously solvated anionic chromophores of green fluorescent protein (GFP) and photoactive yellow protein (PYP). By analyzing the chromophore and solvent configurations, the distributions of vertical excitation energies, the absorption spectra computed within the ensemble approach, and the absorption spectra computed within the ensemble plus zero-temperature Franck-Condon approach, we introduce how solvent, nuclear quantum effects, and vibronic transitions alter the optical absorption spectra. We discover that including nuclear quantum effects in the sampling of chromophore-solvent configurations using ab initio path integral molecular dynamics simulations leads to improved spectral shapes through three mechanisms. The three mechanisms that lead to line shape broadening and a better description of the high-energy tail are softening of heavy atom bonds in the chromophore that couple to the optically bright state, widening the distribution of vertical excitation energies from more diverse solvation environments, and redistributing spectral weight from the 0-0 vibronic transition to higher energy vibronic transitions when computing the Franck-Condon spectrum in a frozen solvent pocket. The absorption spectra computed using the combined ensemble plus zero-temperature Franck-Condon approach yield significant improvements in spectral shape and width compared to spectra computed with the ensemble approach. Using the combined approach with configurations sampled from path integral molecular dynamics trajectories presents a significant step forward in accurately modeling the absorption spectra of aqueously solvated chromophores.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2015

Synchro-curvature radiation of charged particles in the strong curved magnetic fields

It is generally believed that the radiation of relativistic particles in a curved magnetic field proceeds in either the synchrotron or the curvature radiation modes. In this paper we show that in strong curved magnetic fields a significant fraction of the energy of relativistic electrons can be radiated away in the intermediate, the so-called synchro-curvature regime. Because of the persistent change of the trajectory curvature, the radiation varies with the frequency of particle gyration. While this effect can be ignored in the synchrotron and curvature regimes, the variability plays a key role in the formation of the synchro-curvature radiation. Using the Hamiltonian formalism, we find that the particle trajectory has the form of a helix wound around the drift trajectory. This allows us to calculate analytically the intensity and energy distribution of prompt radiation in the general case of magnetic bremsstrahlung in the curved magnetic field. We show that the transition to the limit of the synchrotron and curvature radiation regimes is determined by the relation between the drift velocity and the component of the particle velocity perpendicular to the drift trajectory. The detailed numerical calculations, which take into account the energy losses of particles, confirm the principal conclusions based on the simplified analytical treatment of the problem, and allow us to analyze quantitatively the transition between different radiation regimes for a broad range of initial pitch angles. These calculations demonstrate that even very small pitch angles may lead to significant deviations from the spectrum of the standard curvature radiation when it is formally assumed that a charged particle moves strictly along the magnetic line. We argue that in the case of realization of specific configurations of the electric and magnetic fields, the gamma-ray emission of the pulsar magnetospheres can be dominated by the component radiated in the synchro-curvature regime.

79 ASTRONOMY AND ASTROPHYSICS↗