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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 451 records · Page 25
All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

Use of Sobol’ Variance-Based Global Sensitivity Analysis and Multidimensional Legendre Polynomial Fitting for Reduced Order Modeling

Sandia National Laboratories (SNL) has developed a novel reduced order modeling approach. Prioritization of inputs is accomplished using Sobo' indices obtained through a more efficient variance-based global sensitivity analysis. To determine the Sobo' functions, simulated input values are aligned to collocation points to permit the use of Gauss-Lobatto integration, thereby reducing the number of simulation trials needed by more than an order of magnitude compared to standard Monte Carlo approaches. Furthermore, by leveraging the orthogonality of Legendre polynomials in conjunction with those same simulations at the collocation nodes, an efficient fitting method is developed to represent the Sobo' functions from which a reduced order model (ROM) is constructed. The developed method is both more efficient computationally, and the resulting ROM is more accurate. The efficacy of this technique is demonstrated on a nonlinear polynomial test function as well as the nonlinear Ishigami and Sobo' g functions.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS1983

Explicit Hilbert-space representations of atomic and molecular photoabsorption spectra - Computational studies of Stieltjes-Tchebycheff functions

Computational methods are reported for construction of discrete and continuum Schroedinger states in atoms and molecules employing explicit Hilbert space procedures familiar from bound state studies. As theoretical development, the Schroedinger problem of interest is described, the Cauchy-Lanczos bases and orthonormal polynomials used in constructing L-squared Stieltjes-Tchebycheff (ST) approximations to the discrete and continuum states are defined, and certain properties of these functions are indicated. Advantages and limitations of the ST approach to spectral studies relative to more conventional calculations are discussed, and aspects of the approach in single-channel approximations to larger molecules are described. Procedures are indicated for construction of photoejection anisotropies and for performing coupled-channel calculations employing the ST formalism. Finally, explicit descriptive intercomparisons are made of the nature and diagnostic value of ST functions with more conventional scattering functions.

Hermann, M. R.↗
DOE OSTI2024

Coprecipitation of Fe/Cr Hydroxides at Organic–Water Interfaces: Functional Group Richness and (De)protonation Control Amounts and Compositions of Coprecipitates

Iron/chromium hydroxide coprecipitation controls the fate and transport of toxic chromium (Cr) in many natural and engineered systems. Organic coatings on soil and engineered surfaces are ubiquitous; however, mechanistic controls of these organic coatings over Fe/Cr hydroxide coprecipitation are poorly understood. Here, Fe/Cr hydroxide coprecipitation was conducted on model organic coatings of humic acid (HA), sodium alginate (SA), and bovine serum albumin (BSA). The organics bonded with SiO 2 through ligand exchange with carboxyl (-COOH), and the adsorbed amounts and pK(a) values of -COOH controlled surface charges of coatings. The adsorbed organic films also had different complexation capacities with Fe/Cr ions and Fe/Cr hydroxide particles, resulting in significant differences in both the amount (on HA > SA(-COOH) >> BSA(-NH 2 )) and composition (Cr/Fe molar ratio: on BSA(-NH2) >> HA > SA(-COOH)) of heterogeneous precipitates. Negatively charged -COOH attracted more Fe ions and oligomers of hydrolyzed Fe/Cr species and subsequently promoted heterogeneous precipitation of Fe/Cr hydroxide nanoparticles. Organic coatings containing -NH 2 were positively charged at acidic pH because of the high pK(a) value of the functional group, limiting cation adsorption and formation of coprecipitates. Meanwhile, the higher local pH near the -NH 2 coatings promoted the formation of Cr(OH) 3 . Finally, this study advances fundamental understanding of heterogeneous Fe/Cr hydroxide coprecipitation on organics, which is essential for successful Cr remediation and removal in both natural and engineered settings, as well as the synthesis of Cr-doped iron (oxy)hydroxides for material applications.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2022

Modeling Value Flows in Utility Rate Structures

As the increased adoption of distributed energy resources continues to challenge flat utility rate structures, time-varying rates and more dynamic mechanisms like transactive energy systems can better leverage customer-sited distributed energy resources to provide grid services. However, adopting new utility policies can be a timely process and requires a high level of transparency into the energy system. A wide range of stakeholders must understand who may be affected by policy changes and how. This work employs the valuation methodology developed under Pacific Northwest National Laboratory’s Transactive Systems Program to outline the functional differences in value flow under a series of conventional rate structures and a transactive energy system. The resulting value model illustrates the nuances that arise and highlights future avenues of work that will be necessary as utilities across the country continue to develop new rate structures and market mechanisms.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗
DOE OSTI2018

Smoothness of Generalized Solutions of the Dirichlet Problem for Strongly Elliptic Functional Differential Equations with Orthotropic Contractions

In the disk, we consider the first boundary-value problem for a functional differential equation containing transformations of orthotropic contractions of independent variables of the unknown function. We study the smoothness of generalized solutions inside special-type subdomains and near their boundaries and pose strong ellipticity conditions.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2019

Experimental validation of a nuclear forensics methodology for source reactor-type discrimination of chemically separated plutonium

An experimental validation of a nuclear forensics methodology for the source reactor-type discrimination of separated weapons-useable plutonium is presented. The methodology uses measured values of intra-element isotope ratios of plutonium and fission product contaminants. MCNP radiation transport codes were used for various reactor core modeling and fuel burnup simulations. A reactor-dependent library of intra-element isotope ratio values as a function of burnup and time since irradiation was created from the simulation results. The experimental validation of the methodology was achieved by performing two low-burnup experimental irradiations, resulting in distinct fuel samples containing sub-milligram quantities of weapons-useable plutonium. The irradiated samples were subjected to gamma and mass spectrometry to measure several intra-element isotope ratios. For each reactor in the library, a maximum likelihood calculation was utilized to compare the measured and simulated intra-element isotope ratio values, producing a likelihood value which is proportional to the probability of observing the measured ratio values, given a particular reactor in the library. The measured intra-element isotope ratio values of both irradiated samples and its comparison with the simulation predictions using maximum likelihood analyses are presented. Finally, the analyses validate the nuclear forensics methodology developed.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗
NASA NTRS1976

Correlations for determining thermodynamic properties of hydrogen-helium gas mixtures at temperatures from 7,000 to 35,000 K

Simple relations for determining the enthalpy and temperature of hydrogen-helium gas mixtures were developed for hydrogen volumetric compositions from 1.0 to 0.7. These relations are expressed as a function of pressure and density and are valid for a range of temperatures from 7,000 to 35,000 K and pressures from 0.10 to 3.14 MPa. The proportionality constant and exponents in the correlation equations were determined for each gas composition by applying a linear least squares curve fit to a large number of thermodynamic calculations obtained from a detailed computer code. Although these simple relations yielded thermodynamic properties suitable for many engineering applications, their accuracy was improved significantly by evaluating the proportionality constants at postshock conditions and correlating these values as a function of the gas composition and the product of freestream velocity and shock angle. The resulting equations for the proportionality constants in terms of velocity and gas composition and the corresponding simple realtions for enthalpy and temperature were incorporated into a flow field computational scheme. Comparison was good between the thermodynamic properties determined from these relations and those obtained by using a detailed computer code to determine the properties. Thus, an appreciable savings in computer time was realized with no significant loss in accuracy.

Zoby, E. V.↗
NASA NTRS2000

Spatiotemporal processing of linear acceleration: primary afferent and central vestibular neuron responses

Spatiotemporal convergence and two-dimensional (2-D) neural tuning have been proposed as a major neural mechanism in the signal processing of linear acceleration. To examine this hypothesis, we studied the firing properties of primary otolith afferents and central otolith neurons that respond exclusively to horizontal linear accelerations of the head (0.16-10 Hz) in alert rhesus monkeys. Unlike primary afferents, the majority of central otolith neurons exhibited 2-D spatial tuning to linear acceleration. As a result, central otolith dynamics vary as a function of movement direction. During movement along the maximum sensitivity direction, the dynamics of all central otolith neurons differed significantly from those observed for the primary afferent population. Specifically at low frequencies (</=0.5 Hz), the firing rate of the majority of central otolith neurons peaked in phase with linear velocity, in contrast to primary afferents that peaked in phase with linear acceleration. At least three different groups of central response dynamics were described according to the properties observed for motion along the maximum sensitivity direction. "High-pass" neurons exhibited increasing gains and phase values as a function of frequency. "Flat" neurons were characterized by relatively flat gains and constant phase lags (approximately 20-55 degrees ). A few neurons ("low-pass") were characterized by decreasing gain and phase as a function of frequency. The response dynamics of central otolith neurons suggest that the approximately 90 degrees phase lags observed at low frequencies are not the result of a neural integration but rather the effect of nonminimum phase behavior, which could arise at least partly through spatiotemporal convergence. Neither afferent nor central otolith neurons discriminated between gravitational and inertial components of linear acceleration. Thus response sensitivity was indistinguishable during 0.5-Hz pitch oscillations and fore-aft movements. The fact that otolith-only central neurons with "high-pass" filter properties exhibit semicircular canal-like dynamics during head tilts might have important consequences for the conclusions of previous studies of sensory convergence and sensorimotor transformations in central vestibular neurons.

NASA Discipline Neuroscience↗
NASA NTRS1991

Computation of three-dimensional flows using two stream functions

An approach to compute 3-D flows using two stream functions is presented. The method generates a boundary fitted grid as part of its solution. Commonly used two steps for computing the flow fields are combined into a single step in the present approach: (1) boundary fitted grid generation; and (2) solution of Navier-Stokes equations on the generated grid. The presented method can be used to directly compute 3-D viscous flows, or the potential flow approximation of this method can be used to generate grids for other algorithms to compute 3-D viscous flows. The independent variables used are chi, a spatial coordinate, and xi and eta, values of stream functions along two sets of suitably chosen intersecting stream surfaces. The dependent variables used are the streamwise velocity, and two functions that describe the stream surfaces. Since for a 3-D flow there is no unique way to define two sets of intersecting stream surfaces to cover the given flow, different types of two sets of intersecting stream surfaces are considered. First, the metric of the (chi, xi, eta) curvilinear coordinate system associated with each type is presented. Next, equations for the steady state transport of mass, momentum, and energy are presented in terms of the metric of the (chi, xi, eta) coordinate system. Also included are the inviscid and the parabolized approximations to the general transport equations.

Greywall, Mahesh S.↗
DOE OSTI2021

Cumulants and correlation functions of net-proton, proton, and antiproton multiplicity distributions in Au+Au collisions at energies available at the BNL Relativistic Heavy Ion Collider

Here, we report a systematic measurement of cumulants, C n , for net-proton, proton, and antiproton multiplicity distributions, and correlation functions, κ n , for proton and antiproton multiplicity distributions up to the fourth order in Au+Au collisions at $\sqrt{s_{NN}}$ = 7.7, 11.5, 14.5, 19.6, 27, 39, 54.4, 62.4, and 200 GeV. The C n and κ n are presented as a function of collision energy, centrality and kinematic acceptance in rapidity, y, and transverse momentum, p T . The data were taken during the first phase of the Beam Energy Scan (BES) program (2010–2017) at the BNL Relativistic Heavy Ion Collider (RHIC) facility. The measurements are carried out at midrapidity (|y| < 0.5) and transverse momentum 0.4 < p T < 2.0 GeV/c, using the STAR detector at RHIC. We observe a nonmonotonic energy dependence ($\sqrt{s_{NN}}$ = 7.7–62.4 GeV) of the net-proton C 4 /C 2 with the significance of 3.1σ for the 0–5% central Au+Au collisions. This is consistent with the expectations of critical fluctuations in a QCD-inspired model. Thermal and transport model calculations show a monotonic variation with $\sqrt{s_{NN}}$. For the multiparticle correlation functions, we observe significant negative values for a two-particle correlation function, κ 2 , of protons and antiprotons, which are mainly due to the effects of baryon number conservation. Furthermore, it is found that the four-particle correlation function, κ 4 , of protons plays a role in determining the energy dependence of proton C 4 /C 1 below 19.6 GeV, which cannot be understood by the effect of baryon number conservation.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS1992

The star formation history of the Large Magellanic Cloud

Deep photometric observations of stars in three fields of the LMC are presented, and these data are interpreted using synthetic CMDs and LFs generated from overshoot models. The field CMDs and LFs with a star formation rate that experienced a large increase (4 +/- 0.5) x 10 exp 9 yr ago is successfully modeled. The precise age of this 'burst' depends sensitively on the characteristics of the models. Classical (i.e., nonovershoot) models yield a burst age about 2 x 10 exp 9 yr younger than the value obtained. An initial mass function with slope of 2.35 (the Salpeter value) and a mean field star metallicity of Fe/H of about -0.7 are consistent with the photometric data and LFs. It is suggested that the star formation rate in the LMC was globally quite low during at least the first half of its lifetime, and that a major event triggered a substantial and relatively sudden increase in the star formation rate throughout the entire LMC which persisted for several 10 exp 9 yr and even up to the present epoch in some parts of that galaxy.

Bertelli, Gianpaolo↗
NASA NTRS1987

The nearby Abell clusters. II - Luminosity and spatial distribution of galaxies in A2175, A2256, and A2384

The luminosity and spatial distributions of galaxies in the nearby Abell clusters A2175, A2256, and A2384 have been studied using an automated object detection, classification, and photometry system. Schecter functions have been fit to the observed luminosity functions of these clusters. Values of the characteristic magnitude Mr(asterisk) at the 'break' in the luminosity function (LF) are found that are within about 0.25 mag of the so-called 'universal' value of Mr(asterisk) for A2256 and A2384. The faint ends of the LFs of these two clusters are fairly flat, with a value of -1.6 that is steeper than the universal value of -1.25. The spatial distributions of galaxies in all three clusters seem to be described fairly well by power laws, with no evidence for constant-density cores, when the cluster center is assumed to be the central D or cD galaxy. These results indicate a strong correlation between the density distribution of galaxies and the presence of a dominant D or cD galaxy in the cluster.

Oegerle, William R.↗
NASA NTRS1980

Calculation of power spectrums from digital time series with missing data points

Two algorithms are developed for calculating power spectrums from the autocorrelation function when there are missing data points in the time series. Both methods use an average sampling interval to compute lagged products. One method, the correlation function power spectrum, takes the discrete Fourier transform of the lagged products directly to obtain the spectrum, while the other, the modified Blackman-Tukey power spectrum, takes the Fourier transform of the mean lagged products. Both techniques require fewer calculations than other procedures since only 50% to 80% of the maximum lags need be calculated. The algorithms are compared with the Fourier transform power spectrum and two least squares procedures (all for an arbitrary data spacing). Examples are given showing recovery of frequency components from simulated periodic data where portions of the time series are missing and random noise has been added to both the time points and to values of the function. In addition the methods are compared using real data. All procedures performed equally well in detecting periodicities in the data.

Murray, C. W., Jr.↗
DOE OSTI2020

The functional roles of species in metacommunities, as revealed by metanetwork analyses of bird–plant frugivory networks

Abstract Understanding how biodiversity and interaction networks change across environmental gradients is a major challenge in ecology. We integrated metacommunity and metanetwork perspectives to test species’ functional roles in bird–plant frugivory interactions in a fragmented forest landscape in Southwest China, with consequences for seed dispersal. Availability of fruit resources both on and under trees created vertical feeding stratification for frugivorous birds. Bird–plant interactions involving birds feeding only on‐the‐tree or both on and under‐the‐tree (shared) had a higher centrality and contributed more to metanetwork organisation than interactions involving birds feeding only under‐the‐tree. Moreover, bird–plant interactions associated with large‐seeded plants disproportionately contributed to metanetwork organisation and centrality. Consequently, on‐the‐tree and shared birds contributed more to metanetwork organisation whereas under‐the‐tree birds were more involved in local processes. We would expect that species’ roles in the metanetwork will translate into different conservation values for maintaining functioning of seed‐dispersal networks.

Li, Hai‐Dong↗
NASA NTRS2010

Algorithm That Synthesizes Other Algorithms for Hashing

An algorithm that includes a collection of several subalgorithms has been devised as a means of synthesizing still other algorithms (which could include computer code) that utilize hashing to determine whether an element (typically, a number or other datum) is a member of a set (typically, a list of numbers). Each subalgorithm synthesizes an algorithm (e.g., a block of code) that maps a static set of key hashes to a somewhat linear monotonically increasing sequence of integers. The goal in formulating this mapping is to cause the length of the sequence thus generated to be as close as practicable to the original length of the set and thus to minimize gaps between the elements. The advantage of the approach embodied in this algorithm is that it completely avoids the traditional approach of hash-key look-ups that involve either secondary hash generation and look-up or further searching of a hash table for a desired key in the event of collisions. This algorithm guarantees that it will never be necessary to perform a search or to generate a secondary key in order to determine whether an element is a member of a set. This algorithm further guarantees that any algorithm that it synthesizes can be executed in constant time. To enforce these guarantees, the subalgorithms are formulated to employ a set of techniques, each of which works very effectively covering a certain class of hash-key values. These subalgorithms are of two types, summarized as follows: Given a list of numbers, try to find one or more solutions in which, if each number is shifted to the right by a constant number of bits and then masked with a rotating mask that isolates a set of bits, a unique number is thereby generated. In a variant of the foregoing procedure, omit the masking. Try various combinations of shifting, masking, and/or offsets until the solutions are found. From the set of solutions, select the one that provides the greatest compression for the representation and is executable in the minimum amount of time. Given a list of numbers, try to find one or more solutions in which, if each number is compressed by use of the modulo function by some value, then a unique value is generated.

James, Mark↗
DOE OSTI2019

Observational constraints on the tilted flat-XCDM and the untilted nonflat XCDM dynamical dark energy inflation parameterizations

In this work, we constrain tilted spatially-flat and untilted nonflat XCDM dynamical dark energy inflation parameterizations using Planck 2015 cosmic microwave background (CMB) anisotropy data and recent baryonic acoustic oscillations distance measurements, Type Ia supernovae data, Hubble parameter observations, and growth rate measurements. Inclusion of the four non-CMB data sets results in a significant strengthening of the evidence for nonflatness in the nonflat XCDM model from 1.1σ for the CMB data alone to 3.4σ for the full data combination. In this untilted nonflat XCDM case the data favor a spatially-closed model in which spatial curvature contributes a little less than a percent of the current cosmological energy budget; they also mildly favor dynamical dark energy over a cosmological constant at 1.2σ. These data are also better fit by the flat-XCDM parameterization than by the standard ΛCDM model, but only at 0.3σ significance. Current data is unable to rule out dark energy dynamics. The nonflat XCDM parameterization is compatible with the Dark Energy Survey limits on the present value of the rms mass fluctuations amplitude (σ 8 ) as a function of the present value of the nonrelativistic matter density parameter (Ω m ). Furthermore, it does not provide as good a fit to the higher multipole CMB temperature anisotropy data as does the standard tilted flat-ΛCDM model. A number of measured cosmological parameter values differ significantly when determined using the tilted flat-XCDM and the nonflat XCDM parameterizations, including the baryonic matter density parameter and the reionization optical depth.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2018

Subexponentially Growing Hilbert Space and Nonconcentrating Distributions in a Constrained Spin Model

Motivated by recent experiments with two-component Bose–Einstein condensates, we study fully-connected spin models subject to an additional constraint. The constraint is responsible for the Hilbert space dimension to scale only linearly with the system size. We discuss the unconventional statistical physical and thermodynamic properties of such a system, in particular the absence of concentration of the underlying probability distributions. As a consequence, expectation values are less suitable to characterize such systems, and full distribution functions are required instead. Sharp signatures of phase transitions do not occur in such a setting, but transitions from singly peaked to doubly peaked distribution functions of an “order parameter” may be present.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

Emission of a Neutrino Pair During Transitions of an Electron in the Field of the Nucleus of a Hydrogen-Like Atom in One Spatial Dimension

The Dirac equation for a particle – an electron with negative charge equal in magnitude to the elementary charge e{sub 1} in spacetime with one spatial dimension denoted as the z axis and in the field of a point-like charge (Ze{sub 1}) – the nucleus – with the one-dimensional potential φ{sub 1} = – (Ze{sub 1}) |z| (a one-dimensional hydrogen-like atom) is solved. The two-component wave function and the quantum values of the energy are expressed in terms of the Airy function and its zeros. Using the contact Lagrangian of the weak interaction with Fermi constant G{sub 1} = g{sub 1}ħc in such a space, where g{sub 1} is some number, the probability of emission per unit time of a neutrino pair (Ze{sub 1}){sup *}→(Ze{sub 1}) + νν{sup –} by the one-dimensional hydrogen-like atom, which turns out to be proportional to the square of the mass, is found. Prospects for the realization of the considered effect and its possible significance at various stages of the evolution of the Universe are discussed.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗