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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 955 records · Page 53
All sourcesNASA NTRSDOE OSTI
DOE OSTI2016

Charged particle dynamics in the presence of non-Gaussian Lévy electrostatic fluctuations

Full orbit dynamics of charged particles in a 3-dimensional helical magnetic field in the presence of -stable Levy electrostatic fluctuations and linear friction modeling collisional Coulomb drag is studied via Monte Carlo numerical simulations. The Levy fluctuations are introduced to model the effect of non-local transport due to fractional diffusion in velocity space resulting from intermittent electrostatic turbulence. The probability distribution functions of energy, particle displacements, and Larmor radii are computed and showed to exhibit a transition from exponential decay, in the case of Gaussian fluctuations, to power law decay in the case of Levy fluctuations. The absolute value of the power law decay exponents are linearly proportional to the Levy index. Furthermore, the observed anomalous non-Gaussian statistics of the particles' Larmor radii (resulting from outlier transport events) indicate that, when electrostatic turbulent fluctuations exhibit non-Gaussian Levy statistics, gyro-averaging and guiding centre approximations might face limitations and full particle orbit effects should be taken into account.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

Codiscovering graphical structure and functional relationships within data: A Gaussian Process framework for connecting the dots

Most problems within and beyond the scientific domain can be framed into one of the following three levels of complexity of function approximation. Type 1: Approximate an unknown function given input/output data. Type 2: Consider a collection of variables and functions, some of which are unknown, indexed by the nodes and hyperedges of a hypergraph (a generalized graph where edges can connect more than two vertices). Given partial observations of the variables of the hypergraph (satisfying the functional dependencies imposed by its structure), approximate all the unobserved variables and unknown functions. Type 3: Expanding on Type 2, if the hypergraph structure itself is unknown, use partial observations of the variables of the hypergraph to discover its structure and approximate its unknown functions. These hypergraphs offer a natural platform for organizing, communicating, and processing computational knowledge. While most scientific problems can be framed as the data-driven discovery of unknown functions in a computational hypergraph whose structure is known (Type 2), many require the data-driven discovery of the structure (connectivity) of the hypergraph itself (Type 3). We introduce an interpretable Gaussian Process (GP) framework for such (Type 3) problems that does not require randomization of the data, access to or control over its sampling, or sparsity of the unknown functions in a known or learned basis. Its polynomial complexity, which contrasts sharply with the super-exponential complexity of causal inference methods, is enabled by the nonlinear ANOVA capabilities of GPs used as a sensing mechanism.

Science & Technology - Other Topics↗
DOE OSTI2014

Possible evidence of thermodynamic equilibrium in dark matter halos

After deducing the density profiles and gravitational potential functions of eight galaxies from the rotation velocity data from THINGS, we find that the density decreases exponentially with the potential in substantial regions of the halos. This behavior is in agreement with that of a single-component isothermal Boltzmann gas, and it suggests that an effective description in terms of a Boltzmann gas is possible for dark matter in these regions. This could be an indication that dark matter self-interactions are sufficient in strength and number to lead to thermal equilibrium in these regions. We write down the dynamics and boundary conditions for a Boltzmann gas description and examine some of its qualitative and quantitative consequences. Solutions to the dynamical system are determined by three dimensionfull parameters, and they provide reasonable fits to the rotational velocity data in the regions where the Boltzmann-like behavior was found. Unlike in the usual approach to curve fitting, we do not assume a specific form for the dark matter density profile, and we do not require a detailed knowledge of the baryonic content of the galaxy.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2021

`Pink'-beam X-ray powder diffraction profile and its use in Rietveld refinement

The powder diffraction profile obtained with a pink-beam synchrotron X-ray source is described as the convolution of a back-to-back pair of exponentials convoluted with the Gaussian and Lorentzian components of a pseudo-Voigt. We report this new function is employed for the first time in a Rietveld refinement using data collected from a single 100 ps synchrotron X-ray micropulse.

36 MATERIALS SCIENCE↗
DOE OSTI2024

High throughput, accurate gene annotation through AI and HPC-enabled structural analysis

With the advances in next generation sequencing technologies, the number of sequenced genomes is growing exponentially, resulting in a technology bottleneck for the translation of sequence information into usable hypotheses about the function of each gene. We have proposed leveraging our leadership high-performance computing (HPC) resources to help break this annotation bottleneck. Here we design an HPC-based framework to infer gene function from gene sequence by incorporating information about protein structure and interactions predicted by deep learning approaches. Accurate functional prediction and gene annotation using computational methods will facilitate breakthroughs in the genomic sciences essential to understanding and harnessing life processes in bacteria, fungi and plants. The development and applications of the state-of-the-art deep neural networks to protein structural modeling, interaction prediction, sequence comparison, and quality assessment of protein structural models will be made possible by leadership computational resources. These HPC-enabled bioinformatics and molecular modeling tools will provide powerful insights into molecular functions of genes.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2017

ZFIRE: The Evolution of the Stellar Mass Tully–Fisher Relation to Redshift ∼2.2

Using observations made with MOSFIRE on Keck I as part of the ZFIRE survey, we present the stellar mass Tully–Fisher relation at 2.0<z<2.5. The sample was drawn from a stellar-mass-limited, K{sub s}-band-selected catalog from ZFOURGE over the CANDELS area in the COSMOS field. We model the shear of the Hα emission line to derive rotational velocities at 2.2× the scale radius of an exponential disk (V{sub 2.2}). We correct for the blurring effect of a 2D point-spread function (PSF) and the fact that the MOSFIRE PSF is better approximated by a Moffat than a Gaussian, which is more typically assumed for natural seeing. We find for the Tully–Fisher relation at 2.0<z<2.5 that logV{sub 2.2}=(2.18±0.051)+(0.193 ± 0.108)(logM/M{sub ⊙}−10) and infer an evolution of the zero-point of ΔM/M{sub ⊙}=−0.25±0.16 dex or ΔM/M{sub ⊙}=−0.39±0.21 dex compared to z = 0 when adopting a fixed slope of 0.29 or 1/4.5, respectively. We also derive the alternative kinematic estimator S{sub 0.5}, with a best-fit relation logS{sub 0.5}=(2.06±0.032) + (0.211±0.086) (logM/M{sub ⊙}−10), and infer an evolution of ΔM/M{sub ⊙} =−0.45±0.13 dex compared to z<1.2 if we adopt a fixed slope. We investigate and review various systematics, such as PSF effects, projection effects, systematics related to stellar mass derivation, selection biases, and slope. We find that discrepancies between the various literature values are reduced when taking these into account. Our observations correspond well with the gradual evolution predicted by semianalytic models.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1985

Finite Control in Underdamped Distributed Parameter Systems

Specifically, a class of distributed parameter systems is defined using Hilbert space methods based on a partial differential equation model of a structure. In this space a simple, easy to check definition of underdamping is constructed based on the well known single degree of freedom concept of critical damping. It is then shown that if a given distributed parameter system satisfies this definition, each mode of the modal expansion of the solution is in fact an underdamped function of time. It is noted that a distributed parameter system which is underdamped is also uniformly exponentially stable. By appealing to the work of Gibson, a finite dimensional model of the system will yield satisfactory control laws. Furthermore, it is shown that the assumption of the underdamping also allows straightforward computation of rough bounds on the magnitude of the unmodeled or residual modes for a modal truncation scheme. Hence, underdamped systems are precisely that class of distributed parameter systems which are not likely to have spillover problems and which will yield convergence of finite dimensional control laws to control laws which are optimal for the full distributed parameter model of the system.

Inman, D. J.↗
NASA NTRS1986

A mechanism for tectonic deformation on Venus

In the absence of identifiable physiographic features directly associated with plate tectonics, alternate mechanisms are sought for the intense tectonic deformation observed in radar images of Venus. One possible mechanism is direct coupling into an elastic lithosphere of the stresses associated with convective flow in the interior. Spectral Green's function solutions have been obtained for stresses in an elastic lithosphere overlying a Newtonian interior with an exponential depth dependence of viscosity, and a specified surface-density distribution driving the flow. At long wavelengths and for a rigid elastic/fluid boundary condition, horizontal normal stresses in the elastic lid are controlled by the vertical shear stress gradient and are directly proportional to the depth of the density disturbance in the underlying fluid. The depth and strength of density anomalies in the Venusian interior inferred by analyses of long wavelength gravity data suggest that stresses in excess of 100 MPa would be generated in a 10 km thick elastic lid unless a low viscosity channel occurring beneath the lid or a positive viscosity gradient uncouples the flow stresses. The great apparent depth of compensation of topographic features argues against this, however, thus supporting the importance of the coupling mechanism. If there is no elastic lid, stresses will also be very high near the surface, providing also that the viscosity gradient is negative.

Phillips, Roger J.↗
NASA NTRS1987

Performability modeling based on real data: A casestudy

Described is a measurement-based performability model based on error and resource usage data collected on a multiprocessor system. A method for identifying the model structure is introduced and the resulting model is validated against real data. Model development from the collection of raw data to the estimation of the expected reward is described. Both normal and error behavior of the system are characterized. The measured data show that the holding times in key operational and error states are not simple exponentials and that a semi-Markov process is necessary to model the system behavior. A reward function, based on the service rate and the error rate in each state, is then defined in order to estimate the performability of the system and to depict the cost of different types of errors.

Hsueh, M. C.↗
NASA NTRS1994

Spatial variability of outgoing longwave radiation

Data from the Earth Radiation Budget Experiment scanning radiometer aboard the NOAA-9 operational meteorological satellite are used to investigate the spatial variability of Outgoing Longwave Radiation (OLR). Daily and monthly radiation maps at 2.5 deg latitude-longitude scale are used as a basis for the study. The regions of greatest variability are in the tropics and subtropics. Storm tracks such as the South Pacific convergence zone appear as regions of high OLR variability. Spatial spectra in longitude show two regimes of OLR. At large scales (wavenumbers less than 6), the spatial spectrum is flat. For wavenumbers greater than 10, the spectra decrease as wavenumber to the -3 power. The spatial spectrum of daily anomalies from the mean is a strong function of latitude and season, with interesting features. Correlations of daily anomalies from the monthly mean decrease exponentially in latitude but have a damped-wave structure in longitude. The spatial variability of the daily maps, as measured by degree variance, have 10 times the power at degree 24 than the monthly maps, but at scales between 1 and 10, the degree variance is practically the same for daily as for monthly.

Smith, G. Louis↗
NASA NTRS1995

Galacti chemical evolution: Hygrogen through zinc

Using the output from a grid of 60 Type II supernova models (Woosley & Weaver 1995) of varying mass (11 approx. less than (M/solar mass) approx. less than 40) and metallicity (0, 10(exp -4), 0.01, and 1 solar metallicity), the chemical evolution of 76 stable isotopes, from hydrogen to zinc, is calculated. The chemical evolution calculation employs a simple dynamical model for the Galaxy (infall with a 4 Gyr e-folding timescale onto a exponential dsk and 1/r(exp 2) bulge), and standard evolution parameters, such as a Salpeter initial mass function and a quadratic Schmidt star formation rate. The theoretical results are compared in detail with observed stellar abundances in stars with metallicities in the range -3.0 approx. less than (Fe/H) approx. less than 0.0 dex. While our discussion focuses on the solar neighborhood where there are the most observations, the supernova rates, an intrinsically Galactic quality, are also discussed.

Timmes, F. X.↗
NASA NTRS2011

Obtaining the Grobner Initialization for the Ground Flash Fraction Retrieval Algorithm

At optical wavelengths and from the vantage point of space, the multiple scattering cloud medium obscures one's view and prevents one from easily determining what flashes strike the ground. However, recent investigations have made some progress examining the (easier, but still difficult) problem of estimating the ground flash fraction in a set of N flashes observed from space In the study by Koshak, a Bayesian inversion method was introduced for retrieving the fraction of ground flashes in a set of flashes observed from a (low earth orbiting or geostationary) satellite lightning imager. The method employed a constrained mixed exponential distribution model to describe the lightning optical measurements. To obtain the optimum model parameters, a scalar function of three variables (one of which is the ground flash fraction) was minimized by a numerical method. This method has formed the basis of a Ground Flash Fraction Retrieval Algorithm (GoFFRA) that is being tested as part of GOES-R GLM risk reduction.

Solakiewicz, R.↗
DOE OSTI2014

A density functional theory model of mechanically activated silyl ester hydrolysis

To elucidate the mechanism of the mechanically activated dissociation of chemical bonds between carboxymethylated amylose (CMA) and silane functionalized silicon dioxide, we have investigated the dissociation kinetics of the bonds connecting CMA to silicon oxide surfaces with density functional calculations including the effects of force, solvent polarizability, and pH. We have determined the activation energies, the pre-exponential factors, and the reaction rate constants of candidate reactions. The weakest bond was found to be the silyl ester bond between the silicon and the alkoxy oxygen atom. Under acidic conditions, spontaneous proton addition occurs close to the silyl ester such that neutral reactions become insignificant. Upon proton addition at the most favored position, the activation energy for bond hydrolysis becomes 31 kJ mol{sup −1}, which agrees very well with experimental observation. Heterolytic bond scission in the protonated molecule has a much higher activation energy. The experimentally observed bi-exponential rupture kinetics can be explained by different side groups attached to the silicon atom of the silyl ester. The fact that different side groups lead to different dissociation kinetics provides an opportunity to deliberately modify and tune the kinetic parameters of mechanically activated bond dissociation of silyl esters.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2014

A new type of surface waves in a fully degenerate quantum plasma

We study the response of a semi-bounded one-component fully degenerate electron plasma to an initial perturbation, in the electrostatic limit. We show that the part of the electric potential corresponding to surface waves in such plasma can be represented, at large times, as the sum of two terms, one term corresponding to “conventional” (Langmuir) surface waves and the other term representing a new type of surface waves resulting from specific analytic properties of degenerate plasma's dielectric response function. These two terms are characterized by different oscillation frequencies (for a given wave number), and while the “conventional” term's amplitude decays exponentially with time, the new term is characterized by a slower, power-law decay of the oscillation amplitude and is therefore dominant at large times.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2025

Quantum Adiabatic Optimization with Rydberg Arrays: Localization Phenomena and Encoding Strategies

Quantum adiabatic optimization seeks to solve combinatorial problems using quantum dynamics, requiring the Hamiltonian of the system to align with the problem of interest. However, these Hamiltonians are often incompatible with the native constraints of quantum hardware, necessitating encoding strategies to map the original problem into a hardware-conformant form. While the classical overhead associated with such mappings is easily quantifiable and typically polynomial in problem size, it is much harder to quantify their overhead on the quantum algorithm, e.g., the transformation of the adiabatic timescale. In this work, we address this challenge on the concrete example of the encoding scheme proposed in [Nguyen , PRX Quantum , 010316 (2023)], which is designed to map optimization problems on arbitrarily connected graphs into Rydberg atom arrays. We consider the fundamental building blocks underlying this encoding scheme and determine the scaling of the minimum gap with system size along adiabatic protocols. Even when the original problem is trivially solvable, we find that the encoded problem can exhibit an exponentially closing minimum gap. We show that this originates from a quantum coherent effect, which gives rise to an unfavorable localization of the ground-state wave function. On the QuEra Aquila neutral atom machine, we observe such localization and its effect on the success probability of finding the correct solution to the encoded optimization problem. Finally, we propose quantum-aware modifications of the encoding scheme that avoid this quantum bottleneck and lead to an exponential improvement in the adiabatic performance. This highlights the crucial importance of accounting for quantum effects when designing strategies to encode classical problems onto quantum platforms. Published by the American Physical Society 2025

Bombieri, Lisa (ORCID:0009000950422897)↗
DOE OSTI2018

Exponential Synthesis in the Kernel of a Symmetric Convolution

The paper describes a certain class of homogeneous equations of convolution type in spaces of analytic functions on convex domains. We obtain sufficient conditions under which every solution of an equation from this class is approximated by its elementary solutions.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2015

Curved radio spectra of weak cluster shocks

In order to understand certain observed features of arc-like giant radio relics such as the rareness, uniform surface brightness, and curved integrated spectra, we explore a diffusive shock acceleration (DSA) model for radio relics in which a spherical shock impinges on a magnetized cloud containing fossil relativistic electrons. Toward this end, we perform DSA simulations of spherical shocks with the parameters relevant for the Sausage radio relic in cluster CIZA J2242.8+5301, and calculate the ensuing radio synchrotron emission from re-accelerated electrons. Three types of fossil electron populations are considered: a delta-function like population with the shock injection momentum, a power-law distribution, and a power law with an exponential cutoff. The surface brightness profile of the radio-emitting postshock region and the volume-integrated radio spectrum are calculated and compared with observations. We find that the observed width of the Sausage relic can be explained reasonably well by shocks with speed u{sub s}∼3×10{sup 3} km s{sup −1} and sonic Mach number M{sub s}∼3. These shocks produce curved radio spectra that steepen gradually over (0.1–10)ν{sub br} with a break frequency ν{sub br}∼1 GHz if the duration of electron acceleration is ∼60–80 Myr. However, the abrupt increase in the spectral index above ∼1.5 GHz observed in the Sausage relic seems to indicate that additional physical processes, other than radiative losses, operate for electrons with γ{sub e}≳10{sup 4}.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1996

Robust Stabilizing Compensators for Flexible Structures with Collocated Controls

For flexible structures with collocated rate and attitude sensors/actuators, we characterize compensator transfer functions which guarantee modal stability even when stiffness/inertia parameters are uncertain. While the compensators are finite-dimensional, the structure models are allowed to be infinite-dimensional (continuum models), with attendant complexity of the notion of stability; thus exponential stability is not possible and the best we can obtain is strong stability. Robustness is interpreted essentially as maintaining stability in the worst case. The conditions require that the compensator transfer functions be positive real and use is made of the Kalman-Yakubovic lemma to characterize them further. The concept of positive realness is shown to be equivalent to dissipativity in infinite dimensions. In particular we show that for a subclass of compensators it is possible to make the system strongly stable as well as dissipative in an appropriate energy norm.

Balakrishman, A. V.↗