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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 253 records · Page 14
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Delta/Lambda Chirality: From Enantiomers to Diastereomers in Heterometallic Complexes with Chelating Ligands

The Δ/Λ chirality observed in octahedral molecules with chelating ligands represents the major group of “chiral-at-metal” complexes. Upon shifting from mononuclear to polynuclear systems with multiple (≥2) chiral centers, not only enantiomers but also diastereomers should be considered. We present the first, to the best of our knowledge, diastereomeric pairs Δ,Δ,Δ/Λ,Λ,Λ (1) and Δ,Δ,Λ/ Λ,Λ,Δ (2) of the pentanuclear assembly [Mn II (ptac) 3 −Na- Co III (acac) 3 −Na-Mn II (ptac) 3 ] (ptac = 1,1,1-trifluoro-5,5-dimethyl- 2,4-hexanedionate; acac = acetylacetonate). Diastereomers 1 and 2 were isolated in pure form and found to exhibit distinctly different structural characteristics. Importantly, for compounds that are applied as single-source precursors for the quaternary oxide cathode material P2−Na 0.67 Mn 0.67 Co 0.33 O 2 , the diastereomers revealed different thermal behaviors in terms of volatility and thermal stability. Unambiguous assignment of the Mn and Co positions in both diastereomers has been confirmed by the synchrotron X-ray resonant diffraction technique. Oxidation states of metal ions have been verified by the synchrotron X-ray fluorescence spectroscopy. The diastereomerization between 1 and 2 is not taking place in the solid state (crystal-to-crystal), as well as in the gas phase. The transformation between two diastereomers was observed in the solutions of noncoordinating solvents and was related to the polarities of the solvents and diastereomeric molecules.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1990

Ion beam sputtering of in situ superconducting Y-Ba-Cu-O films

Oriented superconducting YBa2Cu3O7 thin films were deposited on yttria stabilized zirconia and SrTiO3 substrates by ion-beam sputtering of a nonstoichiometric oxide target. The films exhibited zero-resistance critical temperatures as high as 83.5 K without post-deposition anneals. Both the deposition rate and the c-lattice parameter data displayed two distinct regimes of dependence on the beam power of the ion source. Low-power sputtering yielded films with large c-dimensions and low Tc. Higher-power sputtering produced a continuous decrease in the c-lattice parameter and increase in critical temperature. Films having the smaller c-lattice parameters were Cu rich. The Cu content of films deposited at beam voltages of 800 V and above increased with increasing beam power.

Klein, J. D.↗
DOE OSTI2020

Direct Recycling of Spent NCM Cathodes through Ionothermal Lithiation

Ionic liquids (ILs) are a family of nonconventional molten salts that offer many advantages, such as negligible vapor pressures, negligible flammability, wide liquidus ranges, good thermal stability, and much synthesis flexibility. The unique solvation environment of these ILs provides new reaction or flux media for controlling formation of solid-state materials with a minimum perturbation of morphologies. A successful lithiation via ionothermal synthesis using a cost-effective Li halide as Li source and recyclable ILs as solvents is reported in this study for the direct recycling of LiNi 1/3 Co 1/3 Mn 1/3 O 2 (NCM 111) cathodes. In addition, the ionic liquids can be readily recycled and reused after ionothermal lithiation. The lithiation of spent cathodes can enable the direct recycling of spent cathode materials in lithium-ion batteries.

25 ENERGY STORAGE↗
NASA NTRS1992

Low-latitude particle precipitation and associated local magnetic disturbances

The paper investigates the O(+) ion and NO(+) ion temperature and temperature anisotropy for a spatially homogeneous auroral F region in the presence of large electric fields perpendicular to the geomagnetic field. The maximum optical emissions at midlatitudes occur in concert with the maximum positive (northward) excursions in the H trace and with rapid fluctuations in the D trace of nearby magnetograms. The source of the particles is inferred to be the ring current, with precipitation occurring when the Dst index is large at the time of the large short-term excursions in the local magnetic field. This result is consistent with the finding of Voss and Smith (1979), derived from a series of rocket measurements of precipitating heavy particles, that the flux correlates better with the product of Dst and the exponential of Kp than with either alone. It is shown that the product of Dst and the amplitude of the short-term excursions in the horizontal component in local magnetograms has better time resolution and better correlation with the observed emission rates than the index using Kp.

Rassoul, H. K.↗
NASA NTRS1994

Highly ionized gas in the Galactic halo

We reexamine the values of electron density n(sub e) and gas pressure P/k in the interstellar medium (ISM) of the Galactic halo, as inferred from C IV emission and absorption lines and using current C IV atomic data. In a homogeneous model with 4.7 less than or equal to log T less than or equal to 5.3, the data are consistent with 0.01 less than or equal to n(sub e) less than or equal to 0.02/cu cm and 2200 less than or equal to P/k less than or equal to 3700/cu cm K, a factor of 2-3 higher than advocated by Martin & Bowyer (1990) and comparable to the thermal pressure in the disk. If some of the C IV absorption arises from nonemitting, photoionized gas, then the inferred density and pressure will increase accordingly. The volume filling factor for homogeneous models ranges from 0.5% to 5%. Because of the constraints arising from filling factor and radiated power, most of the C IV must arise from gas near the peak of the cooling curve, at log t less than or equal to 5.6. We relate both emission-line and absorption-line observations to recent models in which turbulent mixing layers and isobarically cooling supernova remnants (SNRs) provide significant amounts of halo gas at approximately 10(exp 5.3) K and process 20-40 solar mass/yr with a power of approximately 10(exp 41) ergs/sec. Since the observed C IV and N V absorption scale heights have been reported to differ, at 4.9 kpc and 1.6 kpc, respectively, we examine inhomogeneous models with different exponential scale heights of T, P, and SN energy input. The ISM may change its character with distance above the Galactic plane, as superbubbles and mixing layers dominate over isolated SNRs as the source of the C IV. For appropiate scale heights, the midplane pressure is twice the homogeneous values quoted above. The O IV lambda 1034 diffuse emission line, which can be used as a temperature diagnostic of the hot gas, is predicted to be comparable in strength to that of C IV lambda 1549 (approximately 6000 photons/cu cm/s/sr. The ions C IV, N V, and O VI are predicted to show a decreasing trend in vertical extent, with the O IV scale height perhaps as low as approximately 1 kpc.

Shull, J. Michael↗
NASA NTRS1997

Magnetospheric Plasmas: A Direct Measurement of the Ionospheric Source

In a paper of more than a decade ago, the estimated the strength of the ionospheric source and its ability to supply the different plasma regions of the Earth's magnetosphere was reported. The launch of the POLAR spacecraft with the Thermal Ion Dynamics Experiment (TIDE) and the active control of spacecraft potential made possible for the first time the direct measurement of low energy ions moving from the ionosphere into the lobes of the magnetotail. This paper presents data taken during the period of operation of the Plasma Source Instrument (PSI) which maintains the spacecraft potential at about 1.8V positive with respect to the ambient plasma. These data give an in-situ observation of the strength and flow direction of the ionospheric plasmas as it moves outward into the lobes of the tail. A particle trajectory model has been used to trace particles back to the location of the ionospheric source and forward to the entry point of the ions to the plasma sheet. A comparison of measured data with the predictions of the earlier modeling effort will be discussed.

Giles, B. L.↗
NASA NTRS1993

Sources of Na for the Io atmosphere

The physics and geology of Io have been extensively studied, but there has been little discussion of the chemistry. Relatively little is known about Io chemistry, but there are constraints. Further, it will be a long time before improvements will result from direct observation, given the severe difficulties with the Galileo mission. Via laboratory simulation experiments, plausible thermochemical and photochemical processes which determine the nature and amounts of surface constituents of Io are explored. The well-known density of Io shows that the planet overall is rocky. Because the orbit of Io is well within the magnetosphere of Jupiter and because Io only has a thin, transient SO2 atmosphere, the surface is continually sputtered with magnetospheric ions. Complex processes ionize and accelerate the Io surface atoms to keV and MeV energies. Remarkably, only S, O, and Na ions were found by Voyager. Sputtering also produces an atomic cloud of Na and S (O not observable) with a trace of K. Both gaseous and solid SO2 are known from spectroscopic studies. A trace of H2S and possibly CO2 are present. Geologic features are interpreted in terms of elemental S, but there is no direct evidence for this constituent. We thus have a rocky planet which does not have rocks on the surface. Our general goal is to understand the cycling of Na, S, and O through the crust and atmosphere on present-day Io and to understand how Io evolved to this state. A specific objective was to determine the phases on the surface which are the source of the Na in the atmosphere of Io.

Burnett, D. S.↗
DOE OSTI2025

Water effects on NH 3 -SCR over Cu-based small-pore zeolite catalysts: A review

The selective catalytic reduction (SCR) of NO x with NH 3 as the reductant over small-pore Cu-zeolite catalysts is a leading strategy for controlling emissions from diesel engines and mobile sources. While the hydrothermal stability of Cu-zeolites such as Cu-SSZ-13, Cu-SAPO-34, and Cu-SSZ-39 has been extensively studied, the multifaceted role of water vapor under operating conditions has only recently received systematic attention. Water impacts multiple aspects of SCR catalysis, including NO x conversion, N 2 O formation, Cu ion speciation, redox kinetics, and surface reactions. This review comprehensively summarizes recent advances in understanding the effect of water on NH 3 -SCR over Cu-based catalysts. For Cu-SSZ-13, water vapor induces both inhibitory and promotive effects depending on temperature, Cu loading, and Si/Al ratio by altering NH 3 adsorption, Cu mobility, and redox half-cycle kinetics. Studies have revealed that water can suppress ammonium nitrate formation at low temperatures and enhance nitrate pathways at higher temperatures. Over Cu-SAPO-34, water promotes NO conversion by improving Cu(II) reducibility and strengthening Brønsted acidity. First-principles calculations confirm that water-coordinated Cu species lower O 2 activation barriers. In Cu-SSZ-39, water was found to facilitate Cu reduction, migration, and O 2 activation, resulting in superior water tolerance and unexpected catalytic promotion. Both experimental and computational studies highlight that water vapor exerts complex, catalyst-dependent effects on NH 3 -SCR performance, underscoring the need for tailored catalyst designs that leverage beneficial water interactions while minimizing inhibitory impacts.

Ammonia selective catalytic reduction↗
DOE OSTI2023

RAM-SCB Runs on Request at CCMC

The Ring current–Atmosphere interactions Model (RAM) with Self-Consistent magnetic (B) field (SCB) combines a large-scale kinetic model of ring current plasma with a three-dimensional (3-D) force-balanced model of the terrestrial magnetic field. RAM-SCB simulates the evolution of major ion species (H + , O + , and He + by default) and electrons as a function of azimuth, radial distance, energy, and pitch angle. Simulation outputs include the Dst index, and pressure and differential flux of the modeled species, thus providing benefit as a science code and to inform surface charging hazard within the model domain. Version 2.2 of this open-source simulation code has now—as of 8 August 2023—been made available for Runs-On-Request via the Community Coordinated Modeling Center.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2022

Concealed Cathode Degradation in Lithium-Ion Cells with a Ni-Rich Oxide

Difficulties with sourcing cobalt and the interest in increasing cell energy have motivated the development of Ni-rich oxide materials for lithium-ion battery cathodes. Despite the intense research on the topic, there is limited information available on the long-term performance of novel cathode formulations. Here, we evaluate the stability of LiNi 0.9 Mn 0.05 Co 0.05 O 2 in full-cells tested for over five months, assessing how cycling, voltage and electrolyte additives impact cathode aging. We use differential voltage analysis to extract insights about the cathode from the full-cell data and identify the isolation of cathode particles in the delithiated (charged) state as a relevant mode of aging. Importantly, this particular mechanism of cathode aging does not cause immediate cell capacity fade, causing the simple analysis of cell capacity retention to overestimate the cathode stability under the investigated conditions. So, our observations serve as cautionary tale indicating that careful analysis of data from extended testing may be required for assessing the performance of Ni-rich cathodes and for evaluating how these materials are affected by electrolyte additives.

25 ENERGY STORAGE↗
NASA NTRSDate not supplied

Features of Afterbody Radiative Heating for Jupiter Entry

In this extended abstract, a preliminary analysis of a trajectory-based heating and ablation study in the afterbody of a Jovian entry probe is presented. The radiative flux in the afterbody impinging on the backshell of the probe is investigated with and without the presence of ablation product gas. The heritage tangent-slab approximation for radiative heating is shown to underpredict the radiative heating by as much as 50% in the afterbody making the highfidelity, yet computationally expensive, ray-tracing approach necessary to accurately predict the radiative heating predictions. An investigation into the merits of employing the ray-tracing approach for the prediction of the divergence of radiative flux in the afterbody flow field will be presented in the final manuscript. Nonequilibrium effects in the afterbody region will be investigated in the final manuscript including the impact of electron-ion recombination rates. To bound the problem based on the best available knowledge, an uncertainty analysis will be performed. Sources of uncertainty are identified in the ablation modeling, radiation modeling, flowfield kinetics, and thermodynamic properties of select species.

Thermophysics↗
NASA NTRS2010

MG Isotopic Measurement of FIB-Isolated Presolar Silicate Grains

The majority of presolar oxide and silicate grains are ascribed to origins in low-mass red giant and asymptotic giant branch (AGB) stars based on their O isotopic ratios. However, a minor population of these grains (< 10%) has O isotopic ratios incompatible with these sources. Two principle alternative sources are higher-than-solar metallicity (Z) stars or, more likely, supernovae (SN) [1-3]. These rare (Group 4) grains [3] are characterized by enrichments in O-18, and typically also enrichments in O-17. An even rarer subset of grains with extremely large enrichments in O-17 and smaller depletions in O-18 were suggested to come from binary star systems [2]. To establish the origins of these isotopically unusual grains, it is necessary to examine isotopic systems in addition to O. Presolar silicates offer several elements diagnostic of their stellar sources and nuclear processes, including O, Si, Mg, Fe and Ca. However, the database for minor element isotopic compositions in silicates is seriously lacking. To date only two silicate grains have been analyzed for Mg [4] or Fe [5]. One major complicating factor is their small size (average ~230 nm), which greatly limits the number of measurements that can be performed on any one grain and makes it more difficult to obtain statistically relevant data. This problem is compounded because the grains are identified among isotopically solar silicates, which contribute a diluting signal in isotopic measurements [1]. Thus, relatively small isotopic anomalies are missed due to this dilution effect. By applying focused ion beam (FIB) milling, we obtain undiluted Mg isotopic ratios of isolated rare presolar silicate grains to investigate their sources.

Messenger, Scott R.↗
NASA NTRS1997

The X-Ray Spectrum of the Supernova Remnant 1E 0102-72.3

In this letter we present the soft X-ray (5-35A) spectrum of the supernova remnant (SNR) IE 0102-72.3 in the Small Magellanic Cloud, acquired by the reflection grating spectrometer (RGS) aboard ESA's XMM-Newton Observatory. This extended-source X-ray spectrum of unprecedented spectral resolution (lambda/Delta(lambda) approx. 300) permits, for the first time, unabiguous identification and measurement of isolated emission lines and line complexes alike. The diagnostic power of performing spectroscopy using groups of emission lines from single ions is exemplified. In particular, the bright Lyman and helium series lines for light elements (C VI, O VII, O VIII, Ne IX, Ne X and possibly Mg XI & Mg XII) show peculiar ratios, where the values [1s - np] / [1s - (n + l)p] are systematically weaker than expected for electron impact excitation. These measured ratios resemble signatures of recombining or charge exchanging plasmas. We argue that charge exchange, given its large cross section and evidence for inhomogeneous media within the SNR, is a likely mechanism for the observed emission. Also. the well known temperature diagnostics G(T(sub e)) = (i + f)/r of helium- like triplets (O VII & Ne IX) indicate high temperatures, well above the maximum emission temperature T(sub m) for each ion, and consistent with a purely ionizing plasma. The density diagnostics R(n(sub e)) = f / i meanwhile, are consistent with the low density limit, as expected.

Rasmussen, Andrew P.↗
DOE OSTI2022

Accelerator commissioning and rare isotope identification at the Facility for Rare Isotope Beams

In 2008, Michigan State University was selected to establish the Facility for Rare Isotope Beams (FRIB). Construction of the FRIB accelerator was completed in January 2022. Phased accelerator commissioning with heavy ion beams started in 2017 with the normal-conducting ion source and radio-frequency quadrupole. In April 2021, the full FRIB driver linear accelerator (linac) was commissioned, with heavy ion beams accelerated to energies above 200 MeV/nucleon by 324 superconducting radiofrequency (SRF) resonators operating at 2 K and 4 K with liquid-helium cooling. Further, in preparation for high-power operation, a liquid lithium charge stripper was commissioned with heavy ion beams up to uranium-238, followed by the simultaneous acceleration of multiple-charge-state heavy ion beams to energies above 200 MeV/nucleon. In December 2021, selenium-84 was produced with the FRIB target using a krypton-86 primary beam, demonstrating FRIB’s capability for scientific discovery.

07 ISOTOPE AND RADIATION SOURCES↗
NASA NTRS1979

Measurements of plasma flow at the dawn magnetopause by Voyager 1

Measurements are presented showing strong tailward flow of ions along the dawn magnetopause as the Voyager 1 spacecraft crossed the earth's magnetosphere boundary following launch on September 5, 1977. With one exception all of the observed flows occur outside the magnetopause. The particle flux measurements at energies of at least about 30 keV, together with the observed magnetic-field signatures of the boundary crossing, are consistent with a minimum tailward ion energy flow of about (2-7) x 10 to the 17th erg/s at the time of observation. High-time-resolution particle data indicate that the ion flow can vary on a time scale of about 400 ms. These results, together with recent results from several other spacecraft, show conclusively that a source of energetic particles exists sunward of the dawn-dusk meridian

Lanzerotti, L. J.↗
NASA NTRS2013

Investigations of the Formation of Carbon Grains in Circumstellar Outflows

The study of formation and destruction processes of cosmic dust is essential to understand and to quantify the budget of extraterrestrial organic molecules. Although dust with all its components plays an important role in the evolution of interstellar chemistry and in the formation of organic molecules, little is known on the formation and destruction processes of carbonaceous dust. PAHs are important chemical building blocks of interstellar dust. They are detected in interplanetary dust particles and in meteoritic samples. Additionally, observational, laboratory, and theoretical studies have shown that PAHs, in their neutral and ionized forms, are an important, ubiquitous component of the interstellar medium. Also, the formation of PAHs from smaller molecules has not been extensively studied. Therefore, it is imperative that laboratory experiments be conducted to study the dynamic processes of carbon grain formation from PAH precursors. Studies of interstellar dust analogs formed from a variety of PAH and hydrocarbon precursors as well as species that include the atoms O, N, and S, have recently been performed in our laboratory under conditions that simulate interstellar and circumstellar environments. The species formed in the pulsed discharge nozzle (PDN) plasma source are detected and characterized with a high-sensitivity cavity ringdown spectrometer (CRDS) coupled to a Reflectron time-of-flight mass spectrometer (ReTOF-MS), thus providing both spectroscopic and ion mass information in-situ. We report the first set of measurements obtained in these experiments and identify the species present in the experiments and the ions that are formed in the plasma process. From these unique measurements, we derive information on the size and the structure of interstellar dust grain particles, the growth and the destruction processes of interstellar dust and the resulting budget of extraterrestrial organic molecules.

Grains↗
NASA NTRS1994

New detections of interstellar HNO at 2 and 1.2 millimeters: More N-O bonds

The 2(sub 02) to 1(sub 01) and 3(sub 03) to 2(sub 02) transitions of HNO at 163 and 244 GHz have been detected toward several molecular clouds. In conjunction with previous measurements of the 1(sub 01) to 0(sub 00) line at 81 GHz, these observations secure the identification of interstellar HNO. The 2(sub 02) to 1(sub 01) transition of this species has been detected toward NGC 2024, Sgr B2 (NW), W51M, and Dr 21 (OH), while the 3(sub 03) to 2(sub 02) line at 1.2 mm was observed only in NGC 2024. Typical column densities of HNO observed toward these sources are N(sub tot) approximately 10(exp 12) to 10(exp 14)/sq cm, corresponding to fractional abundances of f(sub HNO) approximately 10(exp -11) to 10(exp -10). These values imply NO/HNO ratios of approximately 100 to 800. Both the HNO fractional abundances and NO/HNO ratios are in reasonable agreement with predictions of ion-molecule-type models of interstellar chemistry, provided early-time calculations are used. Such behavior contrasts with that of other nitrogen compounds, whose observed abundances are best duplicated by steady-state calculations. The chemistries of HNO and NO are thus likely to be related. These observations also suggest that interstellar N-O bonds may be more common than previously thought.

Ziurys, L. M.↗