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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 271 records · Page 15
All sourcesNASA NTRSDOE OSTI
NASA NTRS1994

Mosaic organization of DNA nucleotides

Long-range power-law correlations have been reported recently for DNA sequences containing noncoding regions. We address the question of whether such correlations may be a trivial consequence of the known mosaic structure ("patchiness") of DNA. We analyze two classes of controls consisting of patchy nucleotide sequences generated by different algorithms--one without and one with long-range power-law correlations. Although both types of sequences are highly heterogenous, they are quantitatively distinguishable by an alternative fluctuation analysis method that differentiates local patchiness from long-range correlations. Application of this analysis to selected DNA sequences demonstrates that patchiness is not sufficient to account for long-range correlation properties.

NASA Discipline Number 14-10↗
NASA NTRS1982

Multispectral determination of soil moisture-2

Soil moisture data obtained using scatterometers, modular multispectral scanners and passive microwave radiometers were revised and grouped into four field cover types for statistical anaysis. Guymon data are grouped as alfalfa, bare, milo with rows perpendicular to the field view, and milo viewed parallel to the field of view. Dalhart data are grouped as bare combo, stubble, disked stubble, and corn field. Summary graphs combine selected analyses to compare the effects of field cover. The analysis for each of the cover types is presented in tables and graphs. Other tables show elementary statistics, correlation matrices, and single variable regressions. Selected eigenvectors and factor analyses are included and the highest correlating sensor typs for each location are summarized.

Estes, J. E.↗
DOE OSTI2015

A tight L{sub iso}–E{sub p,z}–Γ{sub 0} correlation of gamma-ray bursts

We select a sample of 34 gamma-ray bursts (GRBs) whose Γ{sub 0} values are derived with the onset peaks observed in the afterglow light curves (except for GRB 060218, whose Γ{sub 0} is estimated with its radio data), and investigate the correlations among Γ{sub 0}, the isotropic peak luminosity (L{sub iso}), and the peak energy (E{sub p,z}) of the νf{sub ν} spectrum in the cosmological rest frame. An analysis of pair correlations among these observables well confirms the results reported by the previous papers. More interestingly, a tight correlation among L{sub iso}, E{sub p,z}, and Γ{sub 0} is found from a multiple regression analysis, which takes the form of L{sub iso}∝E{sub p,z}{sup 1.34±0.14}Γ{sub 0}{sup 1.32±0.19} or E{sub p,z}∝L{sub iso}{sup 0.55±0.06}Γ{sub 0}{sup −0.50±0.17}. Nine other GRBs whose Γ{sub 0} are derived via the pair production opacity constraint also follow such a correlation. Excluding GRB 060218, the L{sub iso}−E{sub p,z}−Γ{sub 0} correlation is valid, and it even holds in the jet co-moving frame. However, GRB 060218 deviates the L{sub iso}{sup ′}−E{sub p}{sup ′} relation of typical GRBs in the jet co-moving frame with 3σ. We argue that the L{sub iso}−E{sub p,z}−Γ{sub 0} correlation may be more physical than the L{sub iso}−E{sub p,z} correlation, since physically the relationship between the observed L{sub iso} and E{sub p,z} not only depends on radiation physics, but also depends on the bulk motion of the jet. We explore the possible origins of this correlation and discuss its physical implications for understanding GRB jet composition and radiation mechanisms.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1985

Oscillator strengths of some Ba lines - A treatment including core-valence correlation and relativistic effects

Theoretical calculations of selected excitation energies and oscillator strengths for Ba are presented that overcome the difficulties of previous theoretical treatments. A relativistic effective-core potential treatment is used to account for the relativistic core contraction, but the outermost ten electrons are treated explicitly. Core-valence correlation can be included in this procedure in a rigorous and systematic way through a configuration-interaction calculation. Insight is gained into the importance of relativistic effects by repeating many of the calculations using an all-electron nonrelativistic treatment employing an extended Slater basis set. It is found that the intensity of the intercombination line 3P1-1S0 is accurately determined by accounting for the deviation from LS coupling through spin-orbit mixing with the 1P1 state, and that deviations from the Lande interval rule provide an accurate measure of the degree of mixing.

Bauschlicher, C. W., Jr.↗
NASA NTRS1994

The correlation function of flux-limited X-ray clusters

We show that the spatial correlation function of a flux-limited sample of X-ray-selected clusters of galaxies will exhibit a correlation scale that is smaller than the correlation scale of a volume-limited, richness-limited sample of comparable apparent spatial density. The flux-limited sample contains clusters of different richnesses at different distances: poor groups are found nearby and rich clusters at greater distances. Since the cluster correlation strength is known to increase with richness, the flux-limited sample averages over the correlations of poor and rich clusters. On the other hand, a volume-limited, richness-limited sample has a minimum richness threshold, and a constant mixture of richnesses with redshift. Using the observed correlation scale for rich (R greater than or equal to 1) clusters, r(sub 0)(R greater than or equal to 1) = 21 +/- 2 Mpc/h, that was determined from previous volume-limited studies, we derive for the Roentgen Satellite (ROSAT) flux-limited X-ray cluster sample r(sub 0) (flux-limited) approximately equals 14 Mpc/h, in agreement with the recently observed value of 13.7 +/- 2.3 Mpc/h.

Bahcall, Neta A.↗
DOE OSTI2020

Taming the fixed-node error in diffusion Monte Carlo via range separation

By combining density-functional theory (DFT) and wave function theory via the range separation (RS) of the interelectronic Coulomb operator, we obtain accurate fixed-node diffusion Monte Carlo (FN-DMC) energies with compact multi-determinant trial wave functions. In particular, we combine here short-range exchange-correlation functionals with a flavor of selected configuration interaction known as configuration interaction using a perturbative selection made iteratively (CIPSI), a scheme that we label RS-DFT-CIPSI. One of the take-home messages of the present study is that RS-DFT-CIPSI trial wave functions yield lower fixed-node energies with more compact multi-determinant expansions than CIPSI, especially for small basis sets. Indeed, as the CIPSI component of RS-DFT-CIPSI is relieved from describing the short-range part of the correlation hole around the electron-electron coalescence points, the number of determinants in the trial wave function required to reach a given accuracy is significantly reduced as compared to a conventional CIPSI calculation. Importantly, by performing various numerical experiments, we evidence that the RS-DFT scheme essentially plays the role of a simple Jastrow factor by mimicking short-range correlation effects, hence avoiding the burden of performing a stochastic optimization. Considering the 55 atomization energies of the Gaussian-1 benchmark set of molecules, we show that using a fixed value of mu = 0.5 bohr(-1) provides effective error cancellations as well as compact trial wave functions, making the present method a good candidate for the accurate description of large chemical systems.

Scemama, Anthony↗
NASA NTRS2008

Correlations of the IR Luminosity and Eddington Ratio with a Hard X-ray Selected Sample of AGN

We use the SWIFT Burst Alert Telescope (BAT) sample of hard x-ray selected active galactic nuclei (AGN) with a median redshift of 0.03 and the 2MASS J and K band photometry to examine the correlation of hard x-ray emission to Eddington ratio as well as the relationship of the J and K band nuclear luminosity to the hard x-ray luminosity. The BAT sample is almost unbiased by the effects of obscuration and thus offers the first large unbiased sample for the examination of correlations between different wavelength bands. We find that the near-IR nuclear J and K band luminosity is related to the BAT (14 - 195 keV) luminosity over a factor of 10(exp 3) in luminosity (L(sub IR) approx.equals L(sub BAT)(sup 1.25) and thus is unlikely to be due to dust. We also find that the Eddington ratio is proportional to the x-ray luminosity. This new result should be a strong constraint on models of the formation of the broad band continuum.

Mushotzy, Richard F.↗
NASA NTRS2009

Transition Analysis for the Mars Science Laboratory Entry Vehicle

Viscous Laminar-turbulent transition plays an important role in the design of the Mars Science Laboratory (MSL) entry vehicle. The lift-to-drag ratio required for the precision landing trajectory will be achieved via an angle of attack equal to 16 degrees. At this relatively high angle of attack, the boundary layer flow near the leeward meridian is expected to transition early in the trajectory, resulting in substantially increased heating loads. This paper presents stability calculations and transition correlations for a series of wind tunnel models of the MSL vehicle. Experimentally measured transition onset locations are used to correlate with the N-factor calculations for various wind tunnel conditions. Due to relatively low post-shock Mach numbers near the edge of the boundary layer, the dominant instability waves are found to be of the first mode type. The N-factor values correlating with measured transition onset at selected test points from the Mach 6 conventional facility experiments fall between 3.5 and 4.5 and apparently vary linearly with the wind tunnel unit Reynolds number, indicating strong receptivity effect. The small transition N value is consistent with previous correlations for second-mode dominant transition in the same wind tunnel facility. Stability calculations for stationary and traveling crossflow instability waves in selected configurations indicate that an N value of 4 and 6, respectively, correlates reasonably well with transition onset discerned from one experimentally measured thermographic image.

Chang, Chau-Lyan↗
DOE OSTI2023

The impact of anisotropic redshift distributions on angular clustering

A leading way to constrain physical theories from cosmological observations is to test their predictions for the angular clustering statistics of matter tracers, a technique that is set to become ever more central with the next generation of large imaging surveys. Interpretation of this clustering requires knowledge of the projection kernel, or the redshift distribution of the sources, and the typical assumption is an isotropic redshift distribution for the objects. However, variations in the kernel are expected across the survey footprint due to photometric variations and residual observational systematic effects. Here, we develop the formalism for anisotropic projection and present several limiting cases that elucidate the key aspects. We quantify the impact of anisotropies in the redshift distribution on a general class of angular two-point statistics. In particular, we identify a mode-coupling effect that can add power to auto-correlations, including galaxy clustering and cosmic shear, and remove it from certain cross-correlations. If the projection anisotropy is primarily at large scales, the mode-coupling depends upon its variance as a function of redshift; furthermore, it is often of similar shape to the signal. In contrast, the cross-correlation of a field whose selection function is anisotropic with another one featuring no such variations — such as CMB lensing — is immune to these effects. We discuss explicitly several special cases of the general formalism including galaxy clustering, galaxy-galaxy lensing, cosmic shear and cross-correlations with CMB lensing, and publicly release a code to compute the biases.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS2012

Stellar Populations of Lyman Break Galaxies at z approx. to 1-3 in the HST/WFC3 Early Release Science Observations

We analyze the spectral energy distributions (SEDs) of Lyman break galaxies . (LBGs) at z approx = 1-3 selected using the Hubble Space Telescope (HST) Wide Field Camera 3 (WFC3) UVIS channel filters. These HST /WFC3 obse,rvations cover about 50 arcmin2 in the GOODS-South field as a part of the WFC3 Early Release Science program. These LBGs at z approx = 1-3 are selected using dropout selection criteria similar to high redshift LBGs. The deep multi-band photometry in this field is used to identify best-fit SED models, from which we infer the following results: (1) the photometric redshift estimate of these dropout selected LBGs is accurate to within few percent; (2) the UV spectral slope f3 is redder than at high redshift (z > 3), where LBGs are less dusty; (3) on average, LBGs at .z approx = 1-3 are massive, dustier and more highly star-forming, compared to LBGs at higher redshifts with similar luminosities, though their median values are similar within 1a uncertainties. This could imply that identical dropout selection technique, at all. redshifts, find physically similar galaxies; and (4) the stellar masses of these LBGs are directly proportional to their UV luminosities with a logarithmic slope of approx 0.46, and star-formation rates are proportional to their stellar masses with a logarithmic slope of approx 0.90. These relations hold true - within luminosities probed in this study - for LBGs from z approx = 1.5 to 5. The star-forming galaxies selected using other color-based techniques show similar correlations at z approx = 2, but to avoid any selection biases, and for direct comparison with LBGs at z > 3, a true Lyman break selection at z approx = 2 is essential. The future HST UV surveys,. both wider and deeper, covering a large luminosity range are important to better understand LBG properties, and their evolution.

Hathi, N. P.↗
DOE OSTI2026

Constraining high-energy neutrinos from tidal disruption events with IceCube high-energy starting events

Tidal disruption events (TDEs) have been proposed as candidate sources of high-energy neutrinos. Successful and choked jets, as well as the accretion disk, corona, wind, and outflow regions in a TDE have been examined and shown to produce TeV - PeV neutrinos. In this work, we use the IceCube 12.5 year high energy starting events (HESE) dataset and perform a maximum likelihood analysis to investigate the spatial and temporal correlations between HESE dataset and a selected sample of 89 TDEs. Our results indicate that the currently observed data do not show any significant correlation and hence is consistent with the background only hypothesis. Using this result, we place constraints on the fraction of TDEs harboring intrinsic jets ($f_{\rm jet}$) and the corresponding isotropic-equivalent cosmic ray (CR) energy ($\mathcal{E}_{\rm CR}$). We note that even with limited statistics, we can constrain the parameter space as $\mathcal{E}_{\rm CR} \lesssim 3 \times 10^{53}$ erg for $f_{\rm jet} \gtrsim 0.6$ at more than 90% C.L. Finally, we discuss the theoretical implications of our results and the limits on the all-sky diffuse neutrino flux from TDEs. With more observational data in the electromagnetic band for TDEs and neutrino observations from IceCube and KM3NeT, our analysis can be used to place stringent constraints on physical parameters associated with TDEs.

Mukhopadhyay, Mainak [Fermilab; Chicago U., KICP; ↗
NASA NTRS1992

Real-valued composite filters for correlation-based optical pattern recognition

Advances in the technology of optical devices such as spatial light modulators (SLMs) have influenced the research and growth of optical pattern recognition. In the research leading to this report, the design of real-valued composite filters that can be implemented using currently available SLMs for optical pattern recognition and classification was investigated. The design of real-valued minimum average correlation energy (RMACE) filter was investigated. Proper selection of the phase of the output response was shown to reduce the correlation energy. The performance of the filter was evaluated using computer simulations and compared with the complex filters. It was found that the performance degraded only slightly. Continuing the above investigation, the design of a real filter that minimizes the output correlation energy and the output variance due to noise was developed. Simulation studies showed that this filter had better tolerance to distortion and noise compared to that of the RMACE filter. Finally, the space domain design of RMACE filter was developed and implemented on the computer. It was found that the sharpness of the correlation peak was slightly reduced but the filter design was more computationally efficient than the complex filter.

Rajan, P. K.↗
DOE OSTI2022

Orbital-selective Mott phase and non-Fermi liquid in FePS 3

The layered metal phosphorous trisulfide FePS 3 is reported to be a Mott insulator at ambient conditions and to undergo structural and insulator-metal phase transitions under pressure. However, the character of the resulting metallic states has not been understood clearly so far. Here, we theoretically study the phase transitions of FePS 3 using first-principles methods based on density functional theory and embedded dynamical mean field theory. We find that the Mott transition in FePS 3 can be orbital selective, with t 2g states undergoing a correlation-induced insulator-to-metal transition while e g states remain gapped. We show that this orbital-selective Mott phase, which occurs only when nonhydrostatic pressure is used, is a bad metal (or non-Fermi liquid) with large fluctuating moments due to Hund's coupling. Further application of pressure increases the crystal-field splitting and converts the system to a conventional Fermi liquid with low-spin configurations dominant. Finally, our results show that FePS 3 is an example of a system that realizes an orbital-selective Mott phase, allowing tuning between correlated and uncorrelated metallic properties in an accessible pressure range (≤ 18 GPa).

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
NASA NTRS1978

Orbit Selection for Earth Observation Missions

The orbit selection process is simplified for most earth-oriented satellite missions by a restriction to circular orbits, which reduces the primary orbit characteristics to be determined to only two: altitude and inclination. A number of important mission performance characteristics depend on these choices, however, so a major part of the orbit selection task is concerned with developing the correlating relationships in clear and convenient forms to provide a basis for rational orbit selection procedures. The present approach to that task is organized around two major areas of mission performance, orbit plane precession and coverage pattern development, whose dependence on altitude and inclination is delineated graphically in design chart form. These charts provide a visual grasp of the relationships between the quantities cited above, as well as other important mission performance parameters including viewing time of day (solar), sensor swath width (and fields of view), swath sequencing, and pattern repeat condition and repeat periods.

King, J. C.↗
DOE OSTI2015

Quantum treatment of protons with the reduced explicitly correlated Hartree-Fock approach

The nuclear-electronic orbital (NEO) approach treats select nuclei quantum mechanically on the same level as the electrons and includes nonadiabatic effects between the electrons and the quantum nuclei. The practical implementation of this approach is challenging due to the significance of electron-nucleus dynamical correlation. Herein, we present a general extension of the previously developed reduced NEO explicitly correlated Hartree-Fock (RXCHF) approach, in which only select electronic orbitals are explicitly correlated to each quantum nuclear orbital via Gaussian-type geminal functions. Approximations of the electronic exchange between the geminal-coupled electronic orbitals and the other electronic orbitals are also explored. This general approach enables computationally tractable yet accurate calculations on molecular systems with quantum protons. The RXCHF method is applied to the hydrogen cyanide (HCN) and FHF{sup −} systems, where the proton and all electrons are treated quantum mechanically. For the HCN system, only the two electronic orbitals associated with the CH covalent bond are geminal-coupled to the proton orbital. For the FHF{sup −} system, only the four electronic orbitals associated with the two FH covalent bonds are geminal-coupled to the proton orbital. For both systems, the RXCHF method produces qualitatively accurate nuclear densities, in contrast to mean field-based NEO approaches. The development and implementation of the RXCHF method provide the framework to perform calculations on systems such as proton-coupled electron transfer reactions, where electron-proton nonadiabatic effects are important.

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

Correlating Sampling and Intensity Statistics in Nanoparticle Diffraction Experiments

In this article, [Öztürk, Yan, Hill & Noyan (2014). J. Appl. Cryst. 47, 1016-1025] it was shown that the sampling statistics of diffracting particle populations within a polycrystalline ensemble depended on the size of the constituent crystallites: broad X-ray peak breadths enabled some nano-sized particles to contribute more than one diffraction spot to Debye-Scherrer rings. Here it is shown that the equations proposed by Alexander, Klug & Kummer [J. Appl. Phys. (1948), 19, 742-753] (AKK) to link diffracting particle and diffracted intensity statistics are not applicable if the constituent crystallites of the powder are below 10 nm. In this size range, (i) the one-to-one correspondence between diffracting particles and Laue spots assumed in the AKK analysis is not satisfied, and (ii) the crystallographic correlation between Laue spots originating from the same grain invalidates the assumption that all diffracting plane normals are randomly oriented and uncorrelated. Such correlation produces unexpected results in the selection of diffracting grains. Three or more Laue spots from a given grain for a particular reflection can only be observed at certain wavelengths. In addition, correcting the diffracted intensity values by the traditional Lorentz term, 1/cos [theta], to compensate for the variation of particles sampled within a reflection band does not maintain fidelity to the number of poles contributing to the diffracted signal. A new term, cos [theta]B/cos [theta], corrects this problem.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2016

Spectroscopic evidence for origins of size and support effects on selectivity of Cu nanoparticle dehydrogenation catalysts

Selective dehydrogenation catalysts that produce acetaldehyde from bio-derived ethanol can increase the efficiency of subsequent processes such as C–C coupling over metal oxides to produce 1-butanol or 1,3-butadiene or oxidation to acetic acid. Here, we use in situ X-ray absorption spectroscopy and steady state kinetics experiments to identify Cuδ+ at the perimeter of supported Cu clusters as the active site for esterification and Cu0 surface sites as sites for dehydrogenation. Correlation of dehydrogenation and esterification selectivities to in situ measures of Cu oxidation states show that this relationship holds for Cu clusters over a wide-range of diameters (2–35 nm) and catalyst supports and reveals that dehydrogenation selectivities may be controlled by manipulating either.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗