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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 73 records · Page 4
All sourcesNASA NTRSDOE OSTI
NASA NTRS1979

Infrared telescope on Spacelab 2

The infrared telescope (IRT) on Spacelab 2 which will be the first cryogenically cooled telescope operated from the Orbiter is discussed. Its objectives are to measure the induced environment about the Orbiter and to demonstrate the ability to manage a large volume of superfluid helium in space. The prime astrophysical objectives are to map extended sources of low surface brightness infrared emission, including the zodiacal light, the galactic plane, and extragalactic regions. The IRT design is described, including the f/4 15.2 cm highly baffled Herschelian telescope cooled to 8 K which may scan to within 35 deg of the sun. The focal plane cooled to 3 K consists of nine discrete photoconductors covering the wavelength of 4.5-120 microns in five bands, with a single stellar detector used for aspect determination. Overlapping scans, contiguous orbits, and a six degree per second scan rate permit rapid redundant coverage of 60 % of the sky.

Koch, D.↗
DOE OSTI2025

Linear and Nonlinear X-ray Spectra of Chiral Molecules: X-ray Circular Dichroism, Sum- and Difference-Frequency Generation of Fenchone and Cysteine

Recent advancements in X-ray light sources enable element-sensitive nonlinear spectroscopies for probing molecular chirality. We simulate X-ray absorption spectroscopy, X-ray circular dichroism (XCD), and nonlinear optical/X-ray SFG and DFG (OX SFG/DFG) signals for two prototypical chiral molecules, fenchone and cysteine. Furthermore, our multireference simulations reproduce experimental data and reveal how novel X-ray spectroscopies exploit the site- and element-sensitivity of X-rays to uncover molecular asymmetry. The XCD spectra show strong asymmetries at chiral centers, while distant atoms contribute weaker signals. The OX SFG/DFG signals, under fixed resonant optical excitation, strongly depend on the core and valence excitations. This allows us to introduce two-dimensional (2D) chirality-sensitive valence-core spectroscopy, which provides insight into the overlap between valence orbitals and local molecular asymmetry. Finally, our estimates using realistic laser and X-ray pulse parameters demonstrate that such nonlinear experiments are feasible at XFELs, offering a promising tool for investigating chiral molecules.

Circular dichroism spectroscopy↗
DOE OSTI2025

Single-Molecule Conductance through Hybrid Radially and Linearly π-Conjugated Macromolecules Reveals an Unusual Intramolecular π-Interaction

We describe the design, synthesis, and single-molecule junction conductance of π-electron molecules bearing both radial and linear π-conjugation pathways, whereby cycloparaphenylene (CPP) radial cores are π-extended linearly with aryl alkyne substituents as models for previously reported CPP-arylene ethynylene conjugated polymers. Although radially and linearly conjugated molecules have been studied previously in isolation as junction-bridging molecular electronic units, this is the first study to examine molecules where both topologies are operative. Our results reveal that the presence of radial CPP components within the junction-spanning pathway leads to a reduction in the conductance of the backbone compared to model linear phenyl substituents. Through tight-binding and DFT-based calculations, we attribute this conductance change to intramolecular van der Waals (vdW) interactions between the CPP ring and the junction-spanning arylene-ethynylene molecular backbone. These interactions induce changes in the dihedral angles of the backbone, leading to a reduced overlap of π orbitals within the molecular junction.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2026

Enhanced Interlayer Coupling and Excitons in Twin-Stacked Two-Dimensional Magnetic CrSBr Bilayers

The degree of electronic coupling between individual layers in van der Waals heterostructures offers a route to engineer their magnetic, electronic, and optical functionalities. Using state-of-the-art first-principles calculations, in this work, we demonstrate that the electronic coupling between two monolayers of CrSBr─an anisotropic two-dimensional magnetic semiconductor─is highly nonlinear and nonmonotonic with respect to their relative twist angle, exhibiting a pronounced maximum at the twin-stacking configuration. The coupling strength scales with both the degree of overlap of Br orbitals adjacent to the van der Waals gap and the cosine of half of the interlayer spin angle. This enhanced interlayer electronic coupling leads to excitons delocalized across the two layers, with a polarization dependence that reflects the interlayer spin alignment. Our results reveal a sensitive interplay among twist angle, magnetism, and excitonic properties in twin-stacked CrSBr bilayers, suggesting twin stacking as an effective means for engineering interlayer coupling.

2D materials↗
DOE OSTI2025

Quantum graph models for transport in filamentary switching

The formation of metallic nanofilaments bridging two electrodes across an insulator is a mechanism for resistive switching. Examples of such phenomena include atomic synapses, which constitute a distinct class of memristive devices the behavior of which is closely tied to the properties of the filament. Until recently, experimental investigation of the low-temperature regime and quantum transport effects has been limited. However, with growing interest in understanding the true impacts of the filament on device conductance, comprehending quantum effects has become crucial for quantum neuromorphic hardware. Here, we discuss quantum transport resulting from filamentary switching in a narrow region where the continuous approximation of the contact is not valid, and only a few atoms are involved. In this scenario, the filament can be represented by a graph depicting the adjacency of atoms and the overlap between atomic orbitals. Using the theory of quantum graphs with locally diffusive node scattering, we calculate the scattering amplitude of charge carriers on this graph and explore the interplay between filamentary formation and quantum transport effects.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2026

Pb-Apatite Framework as a Generator of Novel Flat-Band CuO-Based Physics

Based upon density functional theory (DFT) calculations, we present the basic electronic structure of CuPb 9 (PO 4 ) 6 O (Cu-doped lead apatite, aka LK-99), in two scenarios: (1) where the structure is constrained to the P3 symmetry and (2) where no symmetry is imposed. At the DFT level, the former is predicted to be metallic while the latter is found to be a charge-transfer insulator. In both cases the filling of these states is nominally d 9 , consistent with the standard Cu 2+ valence state, and Cu with a local magnetic moment of order 0.7 μ B . In the metallic case we find these states to be unusually flat (∼0.2 eV dispersion), giving a very high density of electronic states (DOS) at the Fermi level that we argue can be a host for novel electronic physics. The flatness of the bands is the likely origin of symmetry-lowering gapping possibilities that would remove the spectral weight from E F . Motivated by some initial experimental observations of metallic or semiconducting behavior, we propose that disorder (likely structural) is responsible for closing the gap. Here, we consider a variety of possibilities that could possibly close the charge-transfer gap but limit consideration to kinds of disorder that preserve electron count. Of the possible kinds we considered (spin disorder, O populating vacancy sites, and Cu on less energetically favorable Pb sites), the local Cu moment, and consequently the charge-transfer gap, remains robust. We conclude that disorder responsible for metallic behavior entails some kind of doping where the electron count changes. Further, we claim that the emergence of the flat bands should be due to weak wave function overlap between the orbitals on Cu and O sites, owing to the directional character of the constituent orbitals. Therefore, finding an appropriate host structure for minimizing hybridization between Cu and O while allowing them to still weakly interact should be a promising route for generating flat bands at E F which can lead to interesting electronic phenomena, regardless of whether LK-99 is a superconductor.

36 MATERIALS SCIENCE↗
NASA NTRS1979

Visual observations from space

Visual observations from space reveal a number of fascinating natural phenomena of interest to meteorologists and aeronomists, such as aurorae, airglow, aerosol layers, lightning, and atmospheric refraction effects. Other man-made radiation, including city lights and laser beacons, are also of considerable interest. Of course, the most widely used space observations are of the large-scale weather systems viewed each day by millions of people on their local television. From lower altitudes than the geostationary meteorological satellite orbits, obliques and overlapping stereo views are possible, allow height information to be obtained directly, often a key element in the use of the photographs for research purposes. However, this note will discuss only the less common observations mentioned at the beginning of this paragraph.

Garriott, O. K.↗
NASA NTRS1980

Carbon Fibers Conductivity Studies

In an attempt to understand the process of electrical conduction in polyacrylonitrile (PAN)-based carbon fibers, calculations were carried out on cluster models of the fiber consisting of carbon, nitrogen, and hydrogen atoms using the modified intermediate neglect of differential overlap (MINDO) molecular orbital (MO) method. The models were developed based on the assumption that PAN carbon fibers obtained with heat treatment temperatures (HTT) below 1000 C retain nitrogen in a graphite-like lattice. For clusters modeling an edge nitrogen site, analysis of the occupied MO's indicated an electron distribution similar to that of graphite. A similar analysis for the somewhat less stable interior nitrogen site revealed a partially localized II electron distribution around the nitrogen atom. The differences in bonding trends and structural stability between edge and interior nitrogen clusters led to a two-step process proposed for nitrogen evolution with increasing HTT.

Yang, C. Y.↗
NASA NTRS1991

Near-Earth asteroids: Metals occurrence, extraction, and fabrication

Near-earth asteroids occur in three principle types of orbits: Amor, Apollo, and Aten. Amor asteroids make relatively close (within 0.3 AU) approaches to the earth's orbit, but do not actually overlap it. Apollo asteroids spend most of their time outside the earth's orbital path, but at some point of close approach to the sun, they cross the orbit of the earth. Aten asteroids are those whose orbits remain inside the earth's path for the majority of their time, with semi-major axes less than 0.1 AU. Near-earth orbit asteroids include: stones, stony-irons, irons, carbonaceous, and super-carbonaceous. Metals within these asteroids include: iron, nickel, cobalt, the platinum group, aluminum, titanium, and others. Focus is on the extraction of ferrous and platinum group metals from the stony-iron asteroids, and the iron asteroids. Extraction of the metal fraction can be accomplished through the use of tunnel-boring-machines (TBM) in the case of the stony-irons. The metals within the story-iron asteroids occur as dispersed granules, which can be separated from the stony fraction through magnetic and gaseous digestion separation techniques. The metal asteroids are processes by drilling and gaseous digestion or by gaseous digestion alone. Manufacturing of structures, housings, framing networks, pressure vessels, mirrors, and other products is accomplished through the chemical vapor deposition (CVD) of metal coating on advanced composites and on the inside of contour-defining inflatables (CDI). Metal coatings on advanced composites provide: resistance to degradation in the hostile environments of space; superior optical properties; superior heat dissipation; service as wear coatings; and service as evidential coatings. Metal coatings on the inside of CDI produce metal load-bearing products. Fibers such as graphite, kevlar, glass, ceramic, metal, etc., can be incorporated in the metal coatings on the inside of CDI producing metal matrix products which exhibit high strength and resist crack propagation.

Westfall, Richard↗
NASA NTRS1984

TDRSS tracking data and orbit determination evaluation

TDRS-1 was launched on April 4, 1983. This paper presents preliminary results of TDRSS tracking data evaluation through September 1983. TDRSS tracking data evaluation is a summary of valid tracking data that characterizes data quality. TDRS-1 orbit accuracy is evaluated by using orbit consistency measured by comparing overlaps of TDRS-1 ephemerides produced from consecutive data arcs. TDRS-1 and user orbit accuracies and consistencies are also estimated. Orbit accuracy is estimated by comparing user orbits based on tracking data obtained both through the TDRSS and from ground-based tracking.

Campion, R. E.↗
NASA NTRS2014

Lunar Reconnaissance Orbiter Orbit Determination Accuracy Analysis

LRO definitive and predictive accuracy requirements were easily met in the nominal mission orbit, using the LP150Q lunar gravity model. center dot Accuracy of the LP150Q model is poorer in the extended mission elliptical orbit. center dot Later lunar gravity models, in particular GSFC-GRAIL-270, improve OD accuracy in the extended mission. center dot Implementation of a constrained plane when the orbit is within 45 degrees of the Earth-Moon line improves cross-track accuracy. center dot Prediction accuracy is still challenged during full-Sun periods due to coarse spacecraft area modeling - Implementation of a multi-plate area model with definitive attitude input can eliminate prediction violations. - The FDF is evaluating using analytic and predicted attitude modeling to improve full-Sun prediction accuracy. center dot Comparison of FDF ephemeris file to high-precision ephemeris files provides gross confirmation that overlap compares properly assess orbit accuracy.

Gravitation↗
NASA NTRSDate not supplied

An Investigation Into Transecting Satellites in Future Space Traffic Management Scenarios

The number of satellites expected to populate the near-Earth space environment is set to dramatically increase in the coming decade as new large constellations are approved and deployed. Current strategies for deploying new batches of these satellites often involve launching into an initial orbit, and then performing apogee raising maneuvers to reach a target altitude. Similarly, end-of-life planning for these constellation satellites can consist of de-orbit burns that lower perigee to permit disposal via re-entry. Both the raising and de-orbiting maneuvers can result in the individual satellites traveling in transecting orbits that have the potential to cross other spacecraft trajectories. While individual large constellations may be able to coexist in separate altitude and inclination bands, having thousands of satellites moving between these bands as new satellites are added and old satellites are removed could pose additional collision risks. Similar concerns have been raised regarding the impact that large numbers of university-class CubeSats might have in terms of their overall collision risk, especially as these satellites typically do not have propulsion systems for active maneuvering. To assess the impact that transecting satellites might have on future space traffic management strategies, this study explored a variety of realistic future scenarios using a high-fidelity simulation tool. The model can simulate the orbit of tens of thousands of resident space objects (RSOs) simultaneously, to include active satellites, debris, rocket bodies, or even future hypothetical satellite constellations, using a realistic force model that incorporates non-spherical gravity, atmospheric drag, and solar radiation pressure, as well as station-keeping. The simulation can be customized to accommodate different methods of calculating the probability of collision, as well as the process for determining probability ellipsoids and screening volumes. This makes it possible to replicate, and compare, different processes used by different spacecraft operators and space situational awareness (SSA) providers. As the model is run forward in time, each conjunction event is recorded, allowing for the analysis of statistics and meta-data related to these events, providing insight into the nature and frequency of potential collisions, such as whether are they active or passive objects, what size are the two objects, and who owns the objects (if known). This information makes it possible to characterize how changes to the status quo affect the number and type of conjunctions that occur, as well as the distributional effects on various types of satellite operators. To assess the general risks that transecting satellites might pose for hypothetical future space object environments, approximately 60,000 new large constellation satellites were considered, in addition to the existing catalog of approximately 7800 known resident space objects (RSOs), over a simulation period of one year. The results indicate that the future space environment will introduce a non-linear increase in conjunction events as the number of RSOs also increase. This will require adjustments to spacecraft fuel budgets in order to conduct the avoidance maneuvers necessary to minimize collision risk, both for existing and new satellites. This increase is due in large part to the higher density of RSOs and the overlap between some constellation orbits. Current catalog objects were shown to require three times more ∆V for collision avoidance (CA) maneuvers in the simulated future environment, and some constellation spacecraft were estimated to devote the majority of their annual ∆V to CA. The impact of small satellites was found to be proportional for the current space environment, and actually decreased in terms of percentage for the future scenario, suggesting that small satellites do not pose an outsized collision risk. Lastly, transecting satellites were found to contribute thousands of additional conjunctions outside of their operational orbit, and may require up to an additional 5% in CA maneuver fuel allocation.

conjunction assessment↗
DOE OSTI2024

Impact of Dihedral Angle in Conjugated Organic Cation on the Structures and Properties of Organic‐Inorganic Lead Iodides

Abstract Conjugated organic cations are intriguing for organic‐inorganic halide perovskites due to their direct participation in the optoelectronic properties of hybrid materials. In conjugated cations, the dihedral angle, or torsion angle, between adjacent aromatic rings is a critical secondary structural element. This angle influences not only the shape of the cations but also the overlap between the π‐orbitals on adjacent rings, thereby affecting their electronic properties. Understanding how variations in the dihedral angle impact the structure and properties of hybrid organic‐inorganic metal halides (HOIMHs) is fundamentally important. In this study, we utilized 2,2′‐dimethyl bipyridinium as the organic cation, reacting it with PbI₂ to form hybrid lead iodides. Remarkably, variations in the dihedral angle between the two pyridinium rings resulted in the formation of two distinct crystal structures with different band gaps. Our findings demonstrate that manipulating the dihedral angle offers a novel approach to controlling the structures and properties of hybrid metal halides with conjugated cations.

Chandra Patra, Bidhan [Department of Chemistry and↗
NASA NTRS1973

Satellite geological and geophysical remote sensing of Iceland

The author has identified the following significant results. A low sun angle (as low as 7 degrees) on ERTS-1 imagery, particularly when the terrain is snow-covered, markedly enhances subtle geologic structure and landforms. Hot springs, discharging into frozen lakes, from an ice-free area which can be easily seen on ERTS-1 imagery. In remote areas ERTS-1 imagery can be used in climatological studies by using the time of lake ice freeze-up and break-up as a measure over large areas. ERTS-1 imagery of the erupting volcano, Kirkjufell, on the island of Heimaey was cloud covered. ERTS-1 provides a powerful new tool for volcanologists to study erupting volcanoes, new deposits of lava, and the direction and areal distribution of the eruption plume. Some success was achieved in a preliminary study, using photogrammetric instrumentation, of measuring relative elevation of mountains using ERTS-1 imagery of iceland, where considerable overlap exists in successive orbits.

Williams, R. S., Jr.↗
NASA NTRS1979

Mission planning parameters for the Space Shuttle large format camera

The paper discusses the impact of various Space Shuttle mission parameters on the efficient and meaningful utilization of the large format camera (LFC) as a photographic acquisition system. Some of the LFC's vital statistics and its mounting within the Orbiter payload are described. LFC characteristics and mounting dictate certain mission parameters. The controlling parameters are orbit inclinations, launch time of year, launch time of day, orbital altitude, mission duration, overlap selection, film capacity, and climatological prediction. A mission case is evaluated relative to controlling parameters and geographical area(s) of interest.

Wood, G. A.↗
NASA NTRS1988

Theoretical spectrum of AlN

Theoretical spectroscopic constants and radiative lifetimes are presented for the low-lying electronic states of AlN and AlN(+). The ground state of AlN is predicted to be X 3Pi, in agreement with earlier theoretical calculations, but the A 3Pi- state is extremely low-lying. The near degeneracy of these states is analogous to the situation for Al2 and implies that sigma and pi bonds are of nearly equal strength. The 3Pi - 3Pi AlN band system observed in emission is assigned as the C 3Pi - X 3Pi transition. The C 3Pi radiative lifetime is estimated as 151, 163, and 175 ns for v-prime = 0, 1, 2 respectively. These lifetimes may be significantly shortened by dissociation by the (1) 5Pi stated. The calculated D(e) of 2.35 eV for the ground state is about half that of the isovalent BN molecule. Thus the bonding in AlN is significantly weaker than for BN owing to the smaller overlaps of the valence orbitals.

Langhoff, Stephen R.↗
NASA NTRS2008

Anomaly Trends for Missions to Mars: Mars Global Surveyor and Mars Odyssey

The long term flight operations of the Mars Global Surveyor and Mars Odyssey spacecraft give us an excellent chance to examine the operations of two long lived spacecraft in orbit around Mars during overlapping time periods. This study examined the anomalies for each mission maintained for NASA at the Jet Propulsion Laboratory. By examining the anomalies each mission encountered during their multiyear missions, trends were identified related to when anomalies occurred during each mission, the types of anomalies encountered, and corrective actions taken to mitigate the effects of the anomalies. As has been discovered in previous studies the numbers of anomalies directly correlate with mission activity and show a decreasing trend with elapsed mission time. Trend analysis also identified a heavy emphasis on software as the source or solution to anomalies for both missions.

Mars↗
NASA NTRS2017

Development and Assessment of the SMAP Enhanced Passive Soil Moisture Product

Launched in January 2015, the National Aeronautics and Space Administration (NASA) Soil Moisture Active Passive (SMAP) observatory was designed to provide frequent global mapping of high-resolution soil moisture and freeze-thaw state every two to three days using a radar and a radiometer operating at L-band frequencies. Despite a hardware mishap that rendered the radar inoperable shortly after launch, the radiometer continues to operate nominally, returning more than two years of science data that have helped to improve existing hydrological applications and foster new ones.Beginning in late 2016 the SMAP project launched a suite of new data products with the objective of recovering some high-resolution observation capability loss resulting from the radar malfunction. Among these new data products are the SMAP Enhanced Passive Soil Moisture Product that was released in December 2016, followed by the SMAPSentinel-1 Active-Passive Soil Moisture Product in April 2017.This article covers the development and assessment of the SMAP Level 2 Enhanced Passive Soil Moisture Product (L2_SM_P_E). The product distinguishes itself from the current SMAP Level 2 Passive Soil Moisture Product (L2_SM_P) in that the soil moisture retrieval is posted on a 9 km grid instead of a 36 km grid. This is made possible by first applying the Backus-Gilbert optimal interpolation technique to the antenna temperature (TA) data in the original SMAP Level 1B Brightness Temperature Product to take advantage of the overlapped radiometer footprints on orbit. The resulting interpolated TA data then go through various correctioncalibration procedures to become the SMAP Level 1C Enhanced Brightness Temperature Product (L1C_TB_E). The L1C_TB_E product, posted on a 9 km grid, is then used as the primary input to the current operational SMAP baseline soil moisture retrieval algorithm to produce L2_SM_P_E as the final output. Images of the new product reveal enhanced visual features that are not apparent in the standard product. Based on in situ data from core validation sites and sparse networks representing different seasons and biomes all over the world, comparisons between L2_SM_P_E and in situ data were performed for the duration of April 1, 2015 October 30, 2016. It was found that the performance of the enhanced 9 km L2_SM_P_E is equivalent to that of the standard 36 km L2_SM_P, attaining a retrieval uncertainty below 0.040 m(exp 3)/m(exp 3) unbiased root-mean-square error (ubRMSE) and a correlation coefficient above 0.800. This assessment also affirmed that the Single Channel Algorithm using the V-polarized TB channel (SCA-V) delivered the best retrieval performance among the various algorithms implemented for L2_SM_P_E, a result similar to a previous assessment for L2_SM_P.

Enhanced↗