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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 145 records · Page 8
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NASA NTRS1978

Re-evaporation of condensed matter during the formation of the solar system

From the properties of matter the conclusion is derived that the mineral assemblage characteristic of most chondritic meteorites is not at all what is expected to form directly from solar matter. Rather, the major minerals of the ordinary chondrites have chemical compositions indicative of formation from a medium greatly depleted in hydrogen and somewhat deficient in oxygen relative to solar elemental abundance ratios. The re-evaporation of condensed material, after separation from a large fraction of the gaseous components of solar matter, will lead to a medium of the appropriate composition. Such re-evaporation must have occurred at a time prior to the formation of many primitive meteorites.

Herndon, J. M.↗
NASA NTRSDate not supplied

Aqueous Alteration on the Ryugu Parent Body Constrained by Chemical Equilibrium Models

The composition of solid samples returned from the asteroid 162173 Ryugu byHayabusa2 indicates aqueous alteration of rocks that formed a parent body of Ryugu [1, 2]. As on parent bodies of carbonaceous chondrites [3-5], Ryugu materials could have went through (1) accretion of anhydrous and reduced rocky grains together with water-rich ices, (2) melting of ices in the body’s interior through release of radiogenic heat [6], and (3)aqueous alteration of rocky and organic materials that produced secondary minerals, salt- and organic-bearing water solutions, gases, and altered organic matter. Although the bulk chemical composition and major mineralogy (phyllosilicates, magnetite, pyrrhotite, carbonates, phosphates, etc.) of Ryugu [1,2]are similar to those of CI carbonaceous chondrites [3-5, 7], the lack of sulfates and a deficiency of oxygen in the returned samples suggest a distinct alteration pathway. Chondritic materials [3-5] do not indicate complete chemical equilibration though low-temperature parent body processes. However, calculations of chemical equilibria in modeling rock-water-gas type systems[e.g., 8, 9], could assess deviations of chondritic materials from equilibrium conditions and constrain partitioning of chemical elements between solid, aqueous, and gas phase for different stages of alteration. Here we constrained speciation of solid, aqueous, and gaseous phases during aqueous alteration on the Ryugu parent body through chemical equilibrium calculations.

M Yu Zolotov↗
NASA NTRS2024

Eddy-Mediated Turbulent Mixing of Oxygen in the Equatorial Pacific

In the tropical Pacific, weak ventilation and intense microbial respiration at depth give rise to a low dissolved oxygen (O 2 ) environment that is thought to be ventilated primarily by the equatorial current system (ECS). The role of mesoscale eddies and vertical mixing as potential pathways of O 2 supply in this region, however, remains poorly known due to sparse observations and coarse model resolution. Using an eddy resolving simulation of ocean circulation and biogeochemistry, we assess the contribution of these processes to the O 2 budget balance and find that vertical mixing of O 2 , which is modulated by the surface wind speed and the vertical shear of the eddying currents, contributes substantially to the replenishment of O 2 in the upper equatorial Pacific thermocline, complementing the advective supply of O 2 by the ECS and meridional circulation at depth. These transport processes vary seasonally in conjunction with the wind: mixing of O 2 into the upper thermocline is strongest during boreal summer and fall when the vertical shear and eddy kinetic energy are intensified. The relationship between eddy activity and the downward mixing of O 2 arises from the modulation of equatorial turbulence by Tropical Instability Waves via their impacts on the vertical shear. This interaction of processes across scales sustains a local pathway of O 2 delivery into the equatorial Pacific interior and highlights the need for adequate observations and models of turbulent mixing and mesoscale processes for understanding and predicting the fate of the tropical Pacific O 2 content in a warmer and more stratified ocean.

Eddy-Mediated↗
DOE OSTI2021

Modeling Disorder in Pyrochlores and Other Anion-Deficient Fluorite Structural Derivative Oxides

Their very flexible chemistry gives oxide materials a richness in functionality and wide technological application. A specific group of oxides that have a structure related to fluorite but with less oxygen, termed anion-deficient fluorite structural derivatives and with pyrochlores being the most notable example, has been shown to exhibit a diversity of useful properties. For example, the possibility to undergo a transition from an ordered to disordered state allows these oxides to have high radiation tolerance. Atomistic-scale calculations in the form of molecular dynamics (MD) and density functional theory (DFT) have been extensively used to understand what drives this order/disorder transition. Here we give a brief overview of how atomistic-scale calculations are utilized in modeling disorder in pyrochlores and other anion-deficient fluorite structural derivatives. We discuss the modeling process from simple point defects to completely disordered structures, the dynamics during the disordering process, and the use of mathematical models to generate ordered solid-solution configurations. We also attempt to identify the challenges in modeling short range order and discuss future directions to more comprehensive models of the disordered structures.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2020

Understanding of A-site deficiency in layered perovskites: promotion of dual reaction kinetics for water oxidation and oxygen reduction in protonic ceramic electrochemical cells

Protonic ceramic electrochemical cells (PCECs) are promising solid-state energy conversion devices which enable the conversion of energy between electricity and hydrogen at intermediate temperatures. Rapid conversion between chemical and electrical energy via PCEC technology will assist in overcoming grand challenges in energy storage. To achieve highly efficient reversible operation between hydrogen production and electricity generation, boosting water-oxidation and oxygen reduction activities of the oxygen electrode while maintaining the durable operation is one of the early-stage technical opportunities. In this study, an A-site deficient layered perovskite (PrBa 0.8 Ca 0.2 ) 0.95 Co 2 O 6–δ has been developed as an oxygen electrode for a PCEC which presents superior electrochemical performances. The electrolysis current density reached as high as –0.72 A cm –2 at 1.3 V, and a peak power density of 0.540 W cm –2 was obtained at 600 °C in electrolysis and fuel cell mode, respectively. The PCEC with the new electrode shows good durability under practical operating conditions for 160 hours in both operating modes with no observable degradation. Here, the reversibility between the electrolysis and fuel cell mode is also successfully demonstrated.

30 DIRECT ENERGY CONVERSION↗
NASA NTRS1995

Unsteady planar diffusion flames: Ignition, travel, burnout

In microgravity, a thin planar diffusion flame is created and thenceforth travels so that the flame is situated at all times at an interface at which the hydrogen and oxygen meet in stoichiometric proportion. If the initial amount of hydrogen is deficient relative to the initial amount of oxygen, then the planar flame will travel further and further into the half volume initially containing hydrogen, until the hydrogen is (virtually) fully depleted. Of course, when the amount of residual hydrogen becomes small, the diffusion flame is neither vigorous nor thin; in practice, the flame is extinguished before the hydrogen is fully depleted, owing to the finite rate of the actual chemical-kinetic mechanism. The rate of travel of the hydrogen-air diffusion flame is much slower than the rate of laminar flame propagation through a hydrogen-air mixture. This slow travel facilitates diagnostic detection of the flame position as a function of time, but the slow travel also means that the time to burnout (extinction) probably far exceeds the testing time (typically, a few seconds) available in earth-sited facilities for microgravity-environment experiments. We undertake an analysis to predict (1) the position and temperature of the diffusion flame as a function of time, (2) the time at which extinction of the diffusion flame occurs, and (3) the thickness of quench layers formed on side walls (i.e., on lateral boundaries, with normal vectors parallel to the diffusion-flame plane), and whether, prior to extinction, water vapor formed by burning will condense on these cold walls.

Fendell, F.↗
DOE OSTI2021

Role of Fe Doping on Local Structure and Electrical and Magnetic Properties of PbTiO 3

In this work, the local structure and multiferroic properties of iron-doped lead titanate (PbTi 1-x Fe x O 3-δ ) samples was investigated over the entire composition range (x = 0-1). Inherent polarization in PbTiO 3 decreases due to Fe 3+ incorporation up to the solubility limit (x similar to 0.3), although homogeneous doping persists only up to x = 0.1. Ti prefers highly distorted oxygen octahedra for any x value, while Fe prefers more symmetric O-deficient polyhedra (Fe-O n ). The charge compensating oxygen vacancies induce local tilting of the Fe-O n polyhedra beyond a critical x value (x ≥ 0.2), promoting magnetic interaction between two adjacent Fe atoms. The strain induced by local heterogeneity could act as a coupling force between magnetic and ferroelectric properties. Fe-rich clusters evolve into ferromagnetic PbFe 12 O 19 with increased Fe doping. PbTi 1-x Fe x O 3-δ (x ≥ 0.3) samples therefore have separate origins for the ferroelectric (PbTi 1-x Fe x O 3-δ ) and magnetic (PbFe 12 O 19 ) phases.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1991

Biospheric-atmospheric coupling on the early Earth

Theoretical calculations performed with a one-dimensional photochemical model have been performed to assess the biospheric-atmospheric transfer of gases. Ozone reached levels to shield the Earth from biologically lethal solar ultraviolet radiation (220-300 nm) when atmospheric oxygen reached about 1/10 of its present atmospheric level. In the present atmosphere, about 90 percent of atmospheric nitrous oxide is destroyed via solar photolysis in the stratosphere with about 10 percent destroyed via reaction with excited oxygen atoms. The reaction between nitrous oxide and excited oxygen atoms leads to the production of nitric oxide in the stratosphere, which is responsible for about 70 percent of the global destruction of oxygen in the stratosphere. In the oxygen/ozone deficient atmosphere, solar photolysis destroyed about 100 percent of the atmospheric nitrous oxide, relegating the production of nitric oxide via reaction with excited oxygen to zero. Our laboratory and field measurements indicate that atmospheric oxygen promotes the biogenic production of N2O and NO via denitrification and the biogenic production of methane by methanogenesis.

Levine, J. S.↗
DOE OSTI2023

Ly α emission in low-redshift most metal-deficient compact star-forming galaxies

ABSTRACT We present observations with the Cosmic Origins Spectrograph onboard the Hubble Space Telescope of nine most metal-deficient compact star-forming galaxies with oxygen abundances 12 + log(O/H) = 6.97–7.23, redshifts z = 0.02811–0.13320, and stellar masses M⋆ ≤ 107 M⊙. We aim to study the properties of Ly α emission in these extremely metal-deficient objects. We find that all nine galaxies are Ly α emitters (LAEs). We examine various relations between the Ly α escape fraction fesc(Ly α) and other characteristics – such as absolute UV magnitude, oxygen abundance, O32 ratio, stellar mass, Lyman-alpha luminosity, and equivalent width EW(Ly α), ionizing photon production efficiency ξion and velocity separation Vsep between the two peaks of the Ly α profile – of a large sample of LAEs, including our lowest metallicity galaxies and other objects from the literature. We find a relatively tight correlation between fesc(Ly α) and two characteristics, EW(Ly α) and Vsep, whereas no correlation is found between fesc(Ly α) and the oxygen abundance. We also find a relatively tight relation between the Ly α and LyC escape fractions. We propose to use the latter relation to estimate indirectly the escaping ionizing radiation in LAEs, when direct measurements of LyC emission are not possible. We show that the global properties of low-z LAEs are very similar to those of z > 6 galaxies. They are thus ideal local proxies for studying physical processes during the epoch of reionization of the Universe.

Izotov, Y. I. (ORCID:0000000214166082)↗
NASA NTRS1989

The origin of micrograins

Using ultraviolet and infrared techniques, researchers investigated the origins of the tiny (approx. 10A) grains whose presence in the interstellar medium (ISM) is inferred from near-infrared photometry (Sellgren, Werner, and Dinerstein 1983; Sellgren 1984). The authors consider two possibilities: (1) that the grains are formed by condensation in stellar atmospheres; or (2) that they are formed by fragmentation of larger grains in interstellar shocks. They searched for evidence of very small grains in circumstellar environments by analyzing ultraviolet extinction curves in binaries containing hot companions, and by searching for the 3.3-micron emission feature in similar systems. The ultraviolet extinction curve analysis could be applied only to oxygen-rich systems, where small carbonaceous grains would not be expected, so these results provide only indirect information. Researchers find a deficiency of grains smaller than 800A in oxygen-rich systems, consistent with theoretical models of grain condensation which suggest that grains grow to large sizes before injection into the interstellar medium. More direct information on carbonaceous micrograins was obtained from the search for the 3.3-micron feature in carbon-rich binaries with hot companions, whose ultraviolet flux should excite the tiny grains to emit in the infrared. No 3.3-micron feature was found, suggesting that the micrograins are absent in these systems. In addition to the negative search for micrograins in circumstellar environments, researchers have also studied the possible association of these grains with shocks in the diffuse interstellar medium. Using Infrared Astronomy Satellite (IRAS) colors as indicators of the presence or absence of the small grains (e.g., Ryter, Puget, and Perault 1987 and references cited therein), researchers systematically searched for them in regions (reflection nebulae) expected to have sufficient ultraviolet flux to make them glow in the infrared. They found that the distribution is not uniform. The researchers propose that production of micrograins by fragmentation of larger grains in shocks could explain this uneven distribution.

Snow, Theodore P., Jr.↗
NASA NTRS2024

Recipes for Forming a Carbon–Rich Giant Planet

The exploration of carbon-to-oxygen ratios has yielded intriguing insights into the composition of close-in giant exoplanets, giving rise to a distinct classification: carbon-rich planets, characterized by a carbon–to–oxygen ratio ≥ 1 in their atmospheres, as opposed to giant planets exhibiting carbon–to–oxygen ratios close to the protosolar value. In contrast, despite numerous space missions dispatched to the outer solar system and the proximity of Jupiter, Saturn, Uranus, and Neptune, our understanding of the carbon-to-oxygen ratio in these giants remains notably deficient. Determining this ratio is crucial as it serves as a marker linking a planet’s volatile composition directly to its formation region within the disk. This article provides an overview of the current understanding of the carbon-to-oxygen ratio in the four gas giants of our solar system and explores why there is yet no definitive dismissal of the possibility that Jupiter, Saturn, Uranus, or Neptune could be considered carbon-rich planets. Additionally, we delve into the three primary formation scenarios proposed in existing literature to account for a bulk carbon-to-oxygen ratio ≥ 1 in a giant planet. A significant challenge lies in accurately inferring the bulk carbon-to-oxygen ratio of our solar system’s gas giants. Retrieval methods involve integrating in situ measurements from entry probes equipped with mass spectrometers and remote sensing observations conducted at microwave wavelengths by orbiters. However, these methods fall short of fully discerning the deep carbon-to-oxygen abundance in the gas giants due to their limited probing depth, typically within the 10–100 bar range. To complement these direct measurements, indirect determinations rely on understanding the vertical distribution of atmospheric carbon monoxide in conjunction with thermochemical models. These models aid in evaluating the deep oxygen abundance in the gas giants, providing valuable insights into their overall composition.

Protosolar nebula↗
DOE OSTI2021

J2229+2725: an extremely low metallicity dwarf compact star-forming galaxy with an exceptionally high [O iii ]λ5007/[O ii ]λ3727 flux ratio of 53

ABSTRACT Using the Large Binocular Telescope (LBT)/Multi-Object Dual Spectrograph (MODS), we have obtained optical spectroscopy of one of the most metal-poor dwarf star-forming galaxies (SFGs) in the local Universe, J2229+2725. This galaxy with a redshift z = 0.0762 was selected from the Data Release 16 of the Sloan Digital Sky Survey (SDSS). Its properties derived from the LBT observations are most extreme among SFGs in several ways. Its oxygen abundance 12 + logO/H = 7.085 ± 0.031 is among the lowest ever observed for an SFG. With its very low metallicity, an absolute magnitude Mg = −16.39 mag, a low stellar mass M⋆ = 9.1 × 106 M⊙, and a very low mass-to-light ratio M⋆/Lg ∼ 0.0166 (in solar units), J2229+2725 deviates strongly from the luminosity–metallicity relation defined by the bulk of the SFGs in the SDSS. J2229+2725 has a very high specific star formation rate sSFR ∼ 75 Gyr−1, indicating very active ongoing star formation. Three other features of J2229+2725 are most striking, being the most extreme among lowest metallicity SFGs: (1) a ratio O32 = I([O iii]λ5007)/I([O ii]λ3727) ∼ 53, (2) an equivalent width of the H β emission line EW(H β) of 577 Å, and (3) an electron number density of ∼1000 cm−3. These properties imply that the starburst in J2229+2725 is very young. Using the extremely high O32 in J2229+2725, we have improved the strong-line calibration for the determination of oxygen abundances in the most metal-deficient galaxies, in the range 12 + logO/H $\lesssim$ 7.3.

Izotov, Y. I.↗
DOE OSTI2023

J1046+4047: an extremely low-metallicity dwarf star-forming galaxy with O32 = 57

ABSTRACT Using the optical spectrum obtained with the Kitt Peak Ohio State Multi-Object Spectrograph mounted on the Apache Point Observatory 3.5 m Telescope and the Sloan Digital Sky Survey spectrum, we study the properties of one of the most metal-poor dwarf star-forming galaxies (SFGs) in the local Universe, J1046+4047. The galaxy, with a redshift z = 0.04874, was selected from the Data Release 16 of the SDSS. Its properties are among the most extreme for SFGs in several ways. The oxygen abundance 12 + log(O/H) = 7.082 ± 0.016 in J1046+4047 is among the lowest ever observed. With an absolute magnitude Mg = −16.51 mag, a low stellar mass M⋆ = 1.8 × 106 M⊙, and a very low mass-to-light ratio M⋆/Lg ∼ 0.0029 (in solar units), J1046+4047 has a very high specific star formation rate sSFR ∼ 430 Gyr−1, indicating very active ongoing star formation. Another striking feature of J1046+4047 is that it possesses a ratio O32 = I([O iii] λ5007)/I([O ii] λ3727) ∼ 57. Using this extremely high O32, we have confirmed and improved the strong-line calibration for the determination of oxygen abundances in the most metal-deficient galaxies, in the range 12 + log(O/H) ≲ 7.65. This improved method is applicable for all galaxies with O32 ≤ 60. We find the H α emission line in J1046+4047 to be enhanced by some non-recombination processes and thus cannot be used for the determination of interstellar extinction.

Izotov, Y. I. (ORCID:0000000214166082)↗
NASA NTRS1990

The mechanism of high-T(sub c) superconductivity due to bound hole mediators: Relationship to ferroelectricity

The mediation by bound holes creating Cooper pairing in high T(sub c) superconductors has its origin in charge transfer excitations on the multivalence cation (virtual excitions) and in bound excitions or polarizations associated with the oxygen 2p electrons. These phenomena are produced and/or enhanced by a high internal electric field which is itself created by virtue of the unique crystal structures and polyhedral building blocks of high T(sub c) materials. The polarizations which can create oxygen holes (in addition to excitions) may be due to simply the internal electric field or to polaronic and electron-deficient bond behavior. This gives rise to two energy-dependent oxygen bands near the Fermi level. The magnitude and direction of the internal electric fields were calculated for Y1Ba2Cu3O(7-delta) (1-2-3) and show strong z-direction fields at the Cu(2), O2, and O3 sites and an even stronger -z direction field at the O4 site. The field calculations also show why electrical conductivity in the 1-2-3 material is essentially in the base plane of the CuO5 pyramid (the CuO2 plane).

Vezzoli, G. C.↗