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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 577 records · Page 32
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Dichotomous Temperature Response in the Electronic Structure of Epitaxially Grown Altermagnet MnTe

The altermagnet candidate MnTe has recently gained significant interest due to its unconventional magnetic ordering. One of the key features of altermagnetism is the momentum-dependent spin-split band and its temperaturedependent evolution. Yet a fully momentum-resolved experimental investigation, including out-of-plane direction, is still lacking. Here, we systematically investigate the electronic structure of epitaxially grown MnTe by using angle-resolved photoemission spectroscopy (ARPES). Our photon-energy-dependent ARPES data reveal significant out-of-plane dispersions consistent with previous theoretical calculations. More interestingly, we identify two distinct temperature-dependent electronic band structure evolutions at different out-of-plane momentum positions: momentum-dependent energy shifts at the nodal plane and substantial spectral weight suppression at the off-nodal plane. These findings may suggest the importance of considering both the itinerant and localized nature of the magnetic ordering and momentum-dependent interactions. Our work provides crucial insights into the complex correlation between momentum, temperature, and electronic structure in MnTe, contributing to a deeper understanding of altermagnetism.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2024

Orbital-selective correlations and renormalized electronic structure in LiFeAs

Multiorbital physics is important to both the correlation physics and topological behavior of quantum materials. LiFeAs is a prototype iron pnictide suitable for in-depth investigation of this issue. Its electronic structure is strikingly different from the prediction of the noninteracting description. Here, a multiorbital Hubbard model is studied using a U(1) slave-spin theory. We demonstrate a mechanism for a substantial change to the Fermi surface, namely, orbital selectivity of the energy-level renormalization cooperating with its counterpart in quasiparticle spectral weight. Using this effect, we show how the dominating features of the electronic structure in LiFeAs are understood by the local correlations alone. In conclusion, our results set the stage to understand the origins and nature of both the unconventional superconductivity and likely electronic topology in this prototype iron pnictide and, more generally, reveal a remarkable degree of universality out of the seemingly complex multiorbital building blocks across a broad range of strongly correlated superconductors.

36 MATERIALS SCIENCE↗
DOE OSTI2024

SPARC-X: Quantum simulations at extreme scale - reactive dynamics from first principles

We have developed the massively parallel electronic structure code SPARC-X: a computational framework for performing Kohn-Sham Density Functional Theory (DFT) calculations that can scale linearly with the number of atoms in the system, while being able to leverage petascale and emerging exascale parallel computers to study chemical phenomena at unprecedented length and time scales. SPARC-X exploits a recent breakthrough in electronic structure methodologies: systematically improvable, strictly local, orthonormal, discontinuous real-space bases that efficiently and systematically capture the local chemistry of the system. With further adaptation using new machine-learning techniques and the use of the massively parallel Spectral Quadrature (SQ) electronic structure method, the algorithmic complexity and prefactor associated with DFT calculations involving semilocal as well as hybrid functionals are dramatically reduced. Using petascale computational resources, SPARC-X enables quantum mechanical simulations at length and time scales previously accessible only by empirical approaches, e.g., 1,000,000 atoms for a few picoseconds using semilocal functionals or 1,000 atoms for a few picoseconds using hybrid functionals. Using exascale resources, the sizes and times targeted are two orders of magnitude larger. Such a capability has applications in a wide variety of chemical sciences, including reactive interfaces where large length- and/or long time-scales are needed and traditional force fields fail. This is particularly important in dynamic catalysis, where bond breaking and formation must be understood in detail. We developed, tested, and employed the SPARC-X framework to understand the photocatalytic properties of TiO 2 nanoparticles, revealing finite size effects that cannot be captured with standard model systems or functionals. This integrated development and application strategy ensures that SPARC-X remains a robust, efficient, and scalable software package for quantum simulations on current petascale and emerging exascale computing resources.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS1972

A survey of local interstellar hydrogen from OAO-2 observations of Lyman alpha absorption

The Wisconsin far ultraviolet spectrometer aboard OAO-2 observed the wavelength region near 1216 A for 69 stars of spectral type B2 or earlier. From the strength of the observed interstellar L sub alpha absorption, atomic hydrogen column densities were derived over distances averaging 300 pc away from the sun. The OAO data were compared to synthetic ultraviolet spectra, originally derived from earlier higher resolution rocket observations, which were computer processed to simulate the effects of absorption by different amounts of hydrogen followed by the instrumental blending.

Savage, B. D.↗
NASA NTRS1978

A theory for chorus generation by energetic electrons during substorms

Previous observations during magnetospheric substorms reveal the existence of relatively narrow band electromagnetic emissions occurring slightly above and below one half of the electron cyclotron frequency in the equatorial magnetosphere beyond the plasmapause. Between these two bands of emission there exists a gap of much lower emission intensity. In this paper an interpretation is presented for these chorus observations wherein the lower emission band is represented by whistler noise and the upper emission band is described by the lowest harmonic of the ordinary mode. These emissions are assumed to be locally generated at the observation point. Both emission bands are excited by power law-distributed energetic electrons with a variable spectral index and a weak loss cone feature. The form of these energetic electrons is similar to the forms observed simultaneously with the chorus emissions. The calculated growth rates show a frequency distribution similar to that of the measured emissions. In addition, the same energetic electron distribution can also produce the electrostatic gyroharmonic emissions often seen by observers in conjunction with chorus emissions during substorms.

Curtis, S. A.↗
NASA NTRS1981

Broadband electrostatic noise and field-aligned currents in Jupiter's middle magnetosphere

Voyager 1 plasma wave observations have revealed the presence of an impulsive electrostatic emission localized to the Jovian middle magnetosphere that appears on the edges of the plasma sheet. This plasma mode has the same spectral and morphological characteristics of an emission that has been extensively studied in the earth's magnetosphere and has been associated with the presence of field-aligned currents. The results of a detailed study of the properties of this Jovian emission are presented by using comparisons with terrestrial observations as a basis for mode identification. The occurrence regions of the waves are compared with the measured magnetic field configuration to establish a correspondence with the plasma sheet. It is argued that this is a quasi-permanent global system of field-aligned currents linking the ionosphere of Jupiter to the middle magnetosphere, which powers energetic plasma heating processes occurring there. On the basis of knowledge of the consequences of field-aligned currents in the terrestrial magnetosphere, a scenario for acceleration/precipitation of inverted V electrons, concomitant aurorae, and energetic (approximately 10 keV) proton deposition into the middle magnetosphere resulting from field-aligned potential drops associated with this current system is suggested.

Barbosa, D. D.↗
NASA NTRS1984

Iron variation within a granitic pluton as determined by near-infrared reflectance

One-hundred fifty-one previously chemically analyzed samples of tonalite from the Lakeview Mountains pluton, southern California batholith, were analyzed for their iron content using near-infrared spectrophotometry. Compared to the earlier analyses of the same sample set by X-ray fluorescence spectrography, the infrared data have higher analytical variance but clearly define patterns of compositional zonation in the pluton which are closely similar to those patterns obtained from X-ray data; petrogenetic interpretations for the pluton would be the same from either data set. Infrared spectral data can be obtained directly in the field with relatively simple instruments and field measurements can be made to average local heterogeneities that often mask significant plutonic variations.

Baird, A. K.↗
NASA NTRS1987

Infrared observations of contaminants from Shuttle flight 51-F

A small helium-cooled infrared telescope, IRT, was flown on the Shuttle in July/August 1985. The principal astrophysical objectives were to measure the large scale structure of sources and the background radiation. A cold shutter was incorporated to permit absolute flux measurements. Additionally, the engineering objectives included setting upper limits on the infrared radiation from the local environment. Even though the local background overwhelmed the astrophysical background, astronomical sources were still detectable superimposed on this background radiation. Data are presented covering the spectral range from 2 microns to 120 microns. The spatial, spectral, and temporal variations are described. Based on the spectral character and variability in different wavelength bands, the background radiation does not appear to have a single origin. In this paper, the results on the Shuttle environment are presented.

Koch, D. G.↗
NASA NTRS1992

Digital Frequency Synthesizer For Radar Astronomy

Report discusses conceptual digital frequency synthesizer part of programmable local oscillator in radar-astronomy system. Phase must remain continuous during adjustments of frequency, phase noise must be low, and spectral purity must be high. Discusses theory of operation in some mathematical detail and presents new analysis of spectral purity of output.

Sadr, Ramin↗
NASA NTRS1991

Direct evidence for stellar wind X-ray absorption in O stars

The observed X-ray spectral distributions from O stars are highly dependent upon the absorbing media traversed. These media include the cold ISM and the 'local' highly ionized dense surrounding medium commonly referred to as the stellar wind or envelope. Since this local absorption may exceed the ISM absorption, the usual practice of neglecting the local component may lead to underestimates of the intrinsic X-ray fluxes by several orders of magnitude. Previously, the neglect of the local component was justified, since no direct observational evidence supporting local absorption existed. Here evidence is presented for local absorption by showing a correlation between the observed X-ray hardness ratios (an indicator of absorption) and the 6 cm radio data (a measure of the stellar wind column density). It is proposed that this relation may be the first 'positive' confirmation of the existence of the local absorption component.

Waldron, Wayne L.↗
NASA NTRS1991

Global environmental monitoring with the EOS multi-angle imaging spectroradiometer (MISR)

The MISR provides a unique opportunity for studying the ecology and climate of the earth through the acquisition of systematic, global multiangle imagery in reflected sunlight. MISR uses nine cameras: a nadir camera and two banks of four cameras each pointed forward and aftward along the spacecraft ground track to image the earth at +/-30.7, +/-45.6, +/-60.0, and +/-72.5 deg. Radiometrically calibrated images at each angle will be obtained in four spectral bands centered at 440, 550, 670, and 860 nm. MISR will take image data in two different spatial resolution modes: local mode, in which selected targets are observed with 240-m spatial sampling, and global mode, where the entire sunlit eEarth is observed continuously with 1.92-km sampling. The instrument is capable of acquiring global coverage every nine days.

Diner, D. J.↗
NASA NTRS1993

A spectral method determination of the first critical Rayleigh number for a low-Prandtl number crystal melt in a cylindrical container

The onset of laminar axisymmetric Rayleigh-Benard convection is investigated for a low-Prandtl number liquid metal in a cylindrical container. All surfaces are considered to be solid and no-slip. Two separate cases are examined for the thermal boundary conditions at the side wall, one with conducting and the other with insulated surface. The governing Boussinesq system is first perturbed and then simplified by introducing a Stokes stream function. Subsequently, a Chebyshev Galerkin spectral model is employed to reduce the simplified system to a system of first-order nonlinear ordinary differential equations. A local stability analysis determines the two values of the first critical Rayleigh number, Ra(sub cl), for the insulated and conducting side walls. As expected, the conducting Ra(sub cl) value of 2882.5 obtained from the present approach exceeded the corresponding insulated Ra(sub cl) value of 2331.6. For the insulated case, an earlier study using a different numerical approach suggests that Ra(sub cl) = 2261.9, while an experimental study measured Ra(sub cl) = 2700.

Dietz, C. M., Jr.↗
NASA NTRS1993

Optical imaging and long-slit spectroscopy of Markarian galaxies with multiple nuclei. I - Basic data

Optical CCD images and long-slit spectroscopic data are presented for over 100 Markarian (UV-excess) galaxies reported in early studies to possess multiple optical nuclei or extreme morphological peculiarities suggestive of galaxy collisions and mergers. Stacked broad-band images are presented with histogram equalization in order to show simultaneously the nuclei and features at very low surface-brightness levels. Morphological properties, luminosities and colors of the integral systems are given. Photometric and image properties of over 200 individual nuclei and giant H II regions have been measured with respect to the local backgrounds in the galaxies using an objective image finding algorithm. Labeled contour plots identify the measured subcomponents. Two-dimensional spectral data are presented, in addition to intensity profiles along the slit in the light of H-alpha + forbidden N II emission lines and adjacent continuum. Nuclear emission-line measurements, reddening estimates, monochromatic continuum magnitudes, and colors are given.

Mazzarella, Joseph M.↗
NASA NTRS1997

SeaWiFS Technical Report Series: Case Studies for SeaWiFS Calibration and Validation - Volume 41

This document provides brief reports, or case studies, on a number of investigations sponsored by the Calibration and Validation Team (CVT) within the Sea-viewing Wide Field-of-view Sensor (SeaWiFS) Project. Chapter I describes the calibration and characterization of the GSFC sphere, which was used in the recent recalibration of the SeaWiFS instrument. Chapter 2 presents a revision of the diffuse attenuation coefficient, K(490), algorithm based on the SeaWiFS wavelengths. Chapter 3 provides an implementation scheme for an algorithm to remove out-of-band radiance when using a sensor calibration based on a finite width (truncated) spectral response function, e.g., between the 1% transmission points. Chapter 4 describes the implementation schemes for the stray light quality flag (local area coverage [LAC] and global area coverage [GAC]) and the LAC stray light correction.

Yeh, Eueng-nan↗
NASA NTRS1993

MESUR Pathfinder Science Investigations

The MESUR (Mars Environmental Survey) Pathfinder mission is the first Discovery mission planned for launch in 1996. MESUR Pathfinder is designed as an engineering demonstration of the entry, descent and landing approach to be employed by the follow-on MESUR Network mission, which will land of order 10 small stations on the surface of Mars to investigate interior, atmospheric and surface properties. Pathfinder is a small Mars lander, equipped with a microrover to deploy instruments and explore the local landing site. Instruments selected for Pathfinder include a surface imager on a 1 m pop-up mast (stereo with spectral filters), an atmospheric structure instrument/surface meteorology package, and an alpha proton x-ray spectrometer. The microrover will carry the alpha proton x-ray spectrometer to a number of different rocks and surface materials and provide close-up imaging...

Golombek, M.↗
NASA NTRS2018

Femtosecond Laser Tagging in 1,1,1,2-Tetrauoroethane with Trace Quantities of Air

Femtosecond laser tagging is demonstrated for the first time in R134a gas, and in mixtures of R134a with small quantities of air. A systematic study of this tagging method is explored through the adjustment of gas pressure, mixture ratio and laser properties. It is found that the signal strength and lifetime are greatest at low pressures for excitation at both the 400 nm and 800 nm laser wavelengths. The relative intensities of two spectral peaks in the near-UV emission change as a function of gas pressure and can potentially be used for local pressure measurements. Single shot precision in pure R134a and R134a with 5% air is demonstrated at the exit of a subsonic pipe flow. The parameter space of these results are chosen to mimic conditions used in the NASA Langley Research Center's Transonic Dynamics Tunnel. The precision and signal lifetime demonstrate the feasibility of using this technique for measuring flowfields that induce airfoil utter.

Zhang, Yibin↗
NASA NTRS2017

Intelligent multi-spectral IR image segmentation

We present a neural network based multi-­‐spectral image segmentation method. A neural network is trained on the selected features of both the objects and background in the longwave (LW) Infrared (IR) images. Multiple iterations of training are performed until the accuracy of the segmentation reaches satisfactory level. The segmentation boundary of the LW image is used to segment the midwave (MW) and shortwave (SW) IR images. A second neural network detects the local discontinuities and refines the accuracy of the local boundaries. The neural net based segmentation method is compared with Wavelet-­‐threshold and Grab-­‐Cut methods. Test results have shown increased accuracy and robustness of this segmentation scheme for multi-­‐spectral IR images.

Torres, Gilbert↗