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At least 775 records · Page 43

Poly(Arylene Ether Imidazole) Surface Films

Films adhere well to some substrates, provide smooth surfaces, and facilitate release from molds. Thin films of thermoplastic poly(arylene ether imidazole)s (PAEI's) particularly suitable for use as surface modifiers for graphite/epoxy or graphite/bismaleimide composite panels. Molecule of PAEI includes imidazole groups along its backbone that co-cure with epoxies or bismaleimides during processing. Films thermally stable and resistant to bombardment by energetic electrons.

Connell, John W.↗

Theoretical characterization of the potential energy surface for NH + NO

The potential energy surface for NH + NO was characterized using complete active space self-consistent field (CASSCF) gradient calculation to determine the stationary point geometries and frequencies followed by CASSCF/internally contracted configuration interaction calculations to refine the energetics. The present results are in qualitative accord with the BAC-MP4 calculations, but there are differences as large as 8 kcal/mol in the detailed energetics.

Walch, Stephen P.↗

Study of the space environmental effects on spacecraft engineering materials

The issue of the effects of the space environment on spacecraft needs to be understood for the long term exposure of structures in space. In order to better understand the effect of these hostile phenomena on spacecraft, several types of studies are worth performing in order to simulate at some level the effect of the environment. For example the effect of protons and electrons impacting structural materials are easily simulated through experiments using the Van de Graff and Pelletron accelerators currently housed at MSFC. Proton fluxes with energies of 700 KeV - 2.5 MeV can be generated and used to impinge on sample targets to determine the effects of the particles. Also the Environmental Effects Facility at MSFC has the capability to generate electron beams with energies from 700 KeV to 2.5 MeV. These facilities will be used in this research to simulate space environmental effects from energetic particles. Ultraviolet radiation, particularly less than 400 nm wavelength, is less well characterized at this time. The Environmental Effects Facility has a vacuum system dedicated to studying the effects of ultraviolet radiation on specific surface materials. This particular system was assembled in a previous study in order to perform a variety of experiments on materials proposed for the Space Station. That system has continued to function as planned and has been used in carrying out portions of the proposed study.

Obrien, Susan K.↗

Energetic Ion and Electron Irradiation of the Icy Galilean Satellites

Galileo Orbiter measurements of energetic ions (20 keV to 100 MeV) and electrons (20-700 keV) in Jupiter's magnetosphere are used, in conjunction with the JPL electron model (less than 40 MeV), to compute irradiation effects in the surface layers of Europa, Ganymede, and Callisto. Significant elemental modifications are produced on unshielded surfaces to approximately centimeter depths in times of less than or equal to 10(exp 6) years, whereas micrometer depths on Europa are fully processed in approximately 10 years. Most observations of surface composition are limited to optical depths of approximately 1 mm, which are indirect contact with the space environment. Incident flux modeling includes Stormer deflection by the Ganymede dipole magnetic field, likely variable over that satellite's irradiation history. Delivered energy flux of approximately 8 x 10(exp 10) keV/square cm-s at Europa is comparable to total internal heat flux in the same units from tidal and radiogenic sources, while exceeding that for solar UV energies (greater than 6 eV) relevant to ice chemistry. Particle energy fluxes to Ganymede's equator and Callisto are similar at approximately 2-3 x 10(exp 8) keV/square cm-s with 5 x 10(exp 9) at Ganymede's polar cap, the latter being comparable to radiogenic energy input. Rates of change in optical reflectance and molecular composition on Europa, and on Ganymede's polar cap, are strongly driven by energy from irradiation, even in relatively young regions. Irradiation of nonice materials can produce SO2 and CO2, detected on Callisto and Europa, and simple to complex hydrocarbons. Iogenic neutral atoms and meteoroids deliver negligible energy approximately 10(exp 4-5) keV/square cm-s but impacts of the latter are important for burial or removal of irradiation products. Downward transport of radiation produced oxidants and hydrocarbons could deliver significant chemical energy into the satellite interiors for astrobiological evolution in putative sub-surface oceans.

Cooper, John F.↗

Chandra Observations of Io and the Io Plasma Torus

Chandra observed the Jovian system for approximately 1 day with ACIS-S in Nov, 1999, and approximately 10 hours with HRC-I in Dec, 2000. Among the many results of great interest to planetary scientists are the detection of x-ray emission from the Io Plasma Torus (IPT) and, very faintly, associated with the Jovian moon Io itself. The IPT is an almost self-generating donut of S and O ions in Io's orbit that ultimately derive from volcanoes on the surface. While EUV and visible emissions from the IPT are relatively well understood to result from low charge state transitions of S and O and from electron impact, the x-ray emissions are too energetic to be explained this way and seem to require the presence of higher charge states of S and O. We present current ideas as to origins of these x-ray emissions.

Elsner, Ronald F.↗

Investigating Combinations of Alkali Metal Oxides and Hydrogenation Catalysts for Reactive Capture of CO2 to Useful C1 Products

As the world endures environmental crises associated with climate change and the rise of atmospheric CO2 concentrations from anthropogenic CO2 emission, carbon capture and utilization (CCU) technologies are increasingly necessary. Reactive carbon capture (RCC) technologies, in which capture and conversion of CO2 occur in a single reactor, are more energetically and economically attractive by avoiding the need to purify, compress, and transport the captured CO2. To this end, dual function materials (DFMs) - composed of sorbents and catalysts co-dispersed on the same high surface area carrier - have been developed. The sorbent component allows for selective capture of CO2 from a gas stream and the catalyst component subsequently performs the in-situ conversion of the adsorbed CO2 upon introduction of a reactive gas (typically H2). The end product of the most established DFM, comprised of Ru and/or Ni with an alkaline sorbent, is methane via the CO2 methanation reaction. While renewable methane would be an excellent transition fuel, fossil methane is inexpensive (averaging $2.57/MMBTU in pre-pandemic 2019) and the economics of renewable methane utilization are noncompetitive. This requires the design and investigation of DFMs that enable CO2 capture and conversion to more valuable and more useful C1 products like CO or methanol (average price of methanol was $20.61/MMBTU in pre-pandemic 2019). These products can then be further upgraded to high energy density synthetic fuels, and related carbonaceous products, for more sustainable alternatives in industries that are difficult to decarbonize, specifically heavy duty vehicles and aviation. Herein, we report various sorbent + catalyst combinations to achieve the production of useful C1 products through reactive capture of CO2.

carbon capture↗

Solar-Energetic-Particle Track-Production Rates at 1 au: Comparing In-Situ Particle Fluxes with Lunar Sample-Derived Track Densities

Heavy ( Z > 26) solar energetic particles (SEPs) with energies ~1 MeV/nucleon are known to leave visible damage tracks in meteoritic materials. The density of such `solar flare tracks' in lunar and asteroidal samples has been used as a measure of a sample's exposure time to space, yielding critical information on planetary space weathering rates, the dynamics and lifetimes of interplanetary dust grains, and the long-term history of solar particle fluxes. Knowledge of the SEP track accumulation rate in planetary materials at 1 au is critical for properly interpreting observed track densities. Here, we use in-situ particle observations of the 0.50-3.0 MeV/nuc Fe-group SEP ux taken by NASA's Advanced Composition Explorer (ACE) to calculate a flux of track-inducing particles at 1 au of 6.0 × 10 5 cm -2 yr -1 str -1 . Using the observed energy spectrum of Fe-group SEPs, we find that the depth distribution of SEP-induced damage tracks inferred from ACE measurements matches closely to that recently measured in lunar sample 64455; however, the magnitude of the ACE-inferred rate is approximately 25× higher than that observed in the lunar sample. We discuss several hypotheses for the nature of this discrepancy, including inefficiencies in track formation, thermal annealing of lunar samples, erosion via space weathering processing, and variations in the SEP flux at the Moon, yet find no satisfactory explanation. We encourage further research on both the nature of SEP track formation in meteoritic materials and the flux of Fe-group SEPs at the lunar surface in recent and geologic times to resolve this discrepancy.

Interplanetary dust↗

Cassini/Huygens Science Instruments, Spacecraft, and Mission

The Cassini spacecraft will take 18 scientific instruments to Saturn. After launch and a seven-year cruise, Cassini will arrive at Saturn and separate into a Saturn orbiter and an atmospheric probe, called Huygens, which will descend to the surface of Titan. The orbiter will orbit the planet for four years, making close flybys of five satellites, including multiple flybys of Titan. Communication with Earth is at X-band; the maximum downlink rate from Saturn is 166 x 10(exp 3) bps. Orbiter instruments are body mounted; the spacecraft must be turned to point some of them toward objects of interest. The orbiter carries 12 instruments. Optical instruments provide imagery and spectrometry. Radar supplies imaging, altimetry, and radiometry. Radio links contribute information about intervening material and gravity fields. Other instruments measure electromagnetic fields and the properties of plasma, energetic particles, and dust particles. The probe is spin stabilized. It returns data via an S-band link to the orbiter. The probe's six instruments include sensors to determine atmospheric physical properties and composition. Radiometric and optical sensors will produce data on thermal balance and obtain images of Titan's atmosphere and surface. Doppler measurements between probe and orbiter will provide wind profiles. Surface sensors will measure impact acceleration, thermal and electrical properties, and, if the surface is liquid, density and refractive index. This design will enable Cassini to determine the composition; the physical, morphological, and geological nature; and the physical and chemical processes of the atmospheres, surfaces, and magnetosphere of the Saturnian system. This paper briefly describes the Cassini mission and spacecraft and, in somewhat more detail, the scientific instruments.

Jaffe, Leonard D.↗

Electrostatic Discharge Testing of Carbon Composite Solar Array Panels for NASA's Planned Europa Mission to Jupiter

The next planned NASA mission to visit Jupiter is known as the Europa Mission. The objective of this mission concept is to enter orbit around Jupiter in order to conduct multiple close flybys of the icy moon Europa. After careful trade studies, the mission designers have selected solar arrays as the baseline power system for the proposed mission rather than more traditional radioisotope thermoelectric generators. In order to examine the risk of using solar arrays, a series of tests were devised to determine the response of a typical solar array coupon to energetic electrons. Test coupons were fabricated and exposed to electrons ranging from 10 keV to 100 keV, at 1 nA/cm2, while being held at both room and cryogenic temperatures and exposed to end of mission radiation levels. While under electron bombardment, electrical discharges were observed and recorded with the majority of discharges occurring with electron energies of 25 keV. The largest effects on discharge size and rate were the decrease in temperature and the reduction of dielectric material on the sample surface. These tests indicate that solar array panels could be used by the planned Europa Mission in the Jovian environment, but that electrostatic discharges could be expected on the carbon composite solar arrays.

carbon composite↗

(abstract) TOPEX/Poseidon: Four Years of Synoptic Oceanography

Exceeding all expectations of measurement precision and accuracy, the US/France TOPEX/Poseidon satellite mission is now in its 5th year. Returning more than 98 percent of the altimetric data, the measured global geocentric height of the sea surface has provided unprecedented opportunities to address a host of scientific problems ranging from the dynamics of ocean circulation to the distribution of internal tidal energy. Scientific highlights of this longest-running altimetric satellite mission include improvements in our understanding of the dynamics and thermodynamics of the large-scale ocean variability, such as, the properties of planetary waves; the energetics of basin-wide gyres; the heat budget of the ocean; and the ocean's response to wind forcing. For the first time, oceanographers have quantitative descriptions of a dynamic variable of the physical state of the global oceans available in near-real-time.

oceanography planetary waves wind forcing sea-surf↗

Kinetic Roughening and Energetics of Tetragonal Lysozyme Crystal Growth: A Preliminary Atomic Force Microscopy Investigation

We examined particulars of crystal growth from measurements obtained at both microscopic and molecular levels. The crystal growth measurements performed at the microscopic level are well characterized by a model that balances the flux of macromolecules towards the crystal surface with the flux of the crystal surface. Numerical evaluation of model with measurements of crystal growth, in time, provided accurate estimates for the average growth velocities. Growth velocities thus obtained were also interpreted using well-established phenomenological theories. Moreover, we find that microscopic measurements of growth velocity measurements obtained as a function of temperature best characterizes changes in crystal growth modes, when present. We also examined the possibility of detecting a change in crystal growth modes at the molecular level using atomic force microscopy, AFM. From preliminary AFM measurements performed at various supersaturations, we find that magnitude of surface height fluctuations, h(x), increases with supersaturation. Further examination of surface height fluctuations using methods established for fluctuation spectroscopy also enabled the discovery of the existence of a characteristic length, c, which may possibly determine the mode of crystal growth. Although the results are preliminary, we establish the non- critical divergence of 5 and the root-mean-square (rms) magnitude of height-height fluctuations as the kinetic roughening transition temperatures are approached. Moreover, we also examine approximate models for interpreting the non-critical behavior of both 6 and rms magnitude of height-height fluctuations, as the solution supersaturation is increased towards the kinetic roughening supersaturation.

Gorti, Sridhar↗

Theoretical characterization of the reaction NH2 + O yields products

The potential energy surface for NH2+O has been characterized using complete active space self-consistent field (CASSCF)/derivative calculations to determine stationary point geometries and frequencies followed by internally contracted configuration interaction (ICCI) calculations to determine the energetics. The calculations predict a NO bond strength of 85.8 kcal/mol for NH2O. The barrier for isomerization of NH2O to trans-HNOH is predicted to be 48.0 kcal/mol and the barriers for H+HNO forming NH2O and NHOH are predicted to be 2.1 and 8.3 kcal/mol, respectively (all corrected for zero-point energy). The computed heats of formation for NH2O and cis- and trans-HNOH are in good agreement with the present results. The barrier for H + HNO yields H2 + NO is computed to be about 0.3 kcal/mol.

Walch, Stephen P.↗

Orbital Transfer Techniques for Round-Trip Mars Missions

The human exploration of Phobos and Deimos or the retrieval of a surface sample launched to low-Mars orbit presents a highly constrained orbital transfer problem. In general, the plane of the target orbit will not be accessible from the arrival or departure interplanetary trajectories with an (energetically optimal) tangential burn at periapsis. The orbital design is further complicated by the addition of a high-energy parking orbit for the relatively massive Deep Space Vehicle to reduce propellant expenditure, while the crew transfers to and from the target orbit in a smaller Space Exploration Vehicle. The proposed strategy shifts the arrival and departure maneuvers away from periapsis so that the apsidal line of the parking orbit lies in the plane of the target orbit, permitting highly efficient plane change maneuvers at apoapsis of the elliptical parking orbit. An apsidal shift during the arrival or departure maneuver is approximately five times as efficient as maneuvering while in Mars orbit, thus significantly reducing the propellant necessary to transfer between the arrival, target, and departure orbits.

human missions↗

Spatial variability of soil hydraulics and remotely sensed soil parameters

The development of methods to correctly interpret remotely sensed information about soil moisture and soil temperature requires an understanding of water and energy flow in soil, because the signals originate from the surface, or from a shallow surface layer, but reflect processes in the entire profile. One formidable difficulty in this application of soil physics is the spatial heterogeneity of natural soils. Earlier work has suggested that the heterogeneity of soil hydraulic properties may be described by the frequency distribution of a single scale factor. The sensitivity of hydraulic and energetic processes to the variation of this scale factor is explored with a suitable numerical model. It is believed that such an analysis can help in deciding how accurately and extensively basic physical properties of field soils need to be known in order to interpret thermal or radar waveband signals. It appears that the saturated hydraulic conductivity needs to be known only to its order of magnitude, and that the required accuracy of the soil water retention function is about 0.02 volume fraction. Furthermore, the results may be helpful in deciding how the total scene or view field, as perceived through a sensor, is composed from the actual mosaic of transient soil properties, such as surface temperature or surface soil moisture. However, the latter proposition presupposes a random distribution of permanent properties, a condition that may not be met in many instances, and no solution of the problem is apparent.

Lascano, R. J.↗

Reduced Energetic Disorders in Dion–Jacobson Perovskites for Efficient and Spectral Stable Blue LEDs

Metal halide perovskites have witnessed great success in green, red, and near-infrared light-emitting diodes (LEDs), yet blue LEDs still lag behind. Reducing undesired energetic disorders – broad n -phases and halide segregation – is considered as the most critical strategy to further improve the performances. Here, the study reports a newly designed and synthesized di-ammonium ligand with rigid π -conjugated rings and additional methyl groups to construct Dion–Jacobson (DJ) structure. Augmented coordination from the extra ammonium site and increased effective bulkiness from methyl groups lead to better distribution control over conventional mono-ammonium ligands. This enhances the radiative recombination of blue emissions in the film with homogeneous energy landscape and improved surface morphology, as evidenced by a series of imaging and mapping techniques. As a result, it demonstrates DJ perovskite LEDs (PeLEDs) with peak external quantum efficiencies of ≈4% at 484 nm and ≈11% at 494 nm, which are among the top reported for pure DJ phase-based PeLEDs in the corresponding wavelength regions. The results deepen the understanding of regulating energetic disorders in perovskite materials via molecular engineering.

36 MATERIALS SCIENCE↗

Correlation of Band Bending and Ionic Losses in 1.68 eV Wide Band Gap Perovskite Solar Cells

Abstract Perovskite solar cells (PSCs) are promising for high‐efficiency tandem applications, but their long‐term stability, particularly due to ion migration, remains a challenge. Despite progress in stabilizing PSCs, they still fall short compared to mature technologies like silicon. This study explores how different piperazinium salt treatments using iodide, chloride, tosylate, and bistriflimide anions affect the energetics, carrier dynamics, and stability of 1.68 eV bandgap PSCs. Chloride‐based treatments achieved the highest power conversion efficiency (21.5%) and open‐circuit voltage (1.28 V), correlating with stronger band bending and n‐type character at the surface. At the same time, they showed reduced long‐term stability due to increased ionic losses. Tosylate‐treated devices offered the best balance, retaining 96.4% efficiency after 1000 h (ISOS‐LC‐1I). These findings suggest that targeted surface treatments can enhance both efficiency and stability in PSCs.

14 SOLAR ENERGY↗

From electricity to fuels: Descriptors for C 1 selectivity in electrochemical CO 2 reduction

Electrochemical reduction of carbon dioxide (CO 2 RR) over transition metals follows a complex reaction network. Here, we combine observations from experimental literature with a theoretical analysis of energetics to rationalize that not all intermediates in the reduction of CO 2 are formed through direct protonation steps. We derive a selectivity map for two-electron products (carbon monoxide (CO) and formate) on pure metal surfaces using only the CO and OH binding energies as descriptors. For the pure metals that are selective towards CO formation, the variation of the CO binding energy is sufficient to further subdivide the map into domains that predominantly form H 2 , CO, and more reduced products. Our analysis rationalizes experimentally observed product distributions in CO 2 RR across pure metal systems. Overall, we highlight the need for additional material screening descriptors for CO 2 R and the importance of considering competition from the elementary steps of the hydrogen evolution reaction.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

The predicted shapes of voids and Xe bubbles in UO 2

Morphology is a fundamental attribute when investigating voids and bubbles in UO 2 . Here we use molecular dynamics and Monte Carlo simulations to predict the lowest energy shapes for voids and bubbles in UO 2 . The energies of the {100}, {110} and {111} surfaces have been calculated and used to predict the equilibrium void shape from Wulff construction. This equilibrium shape is compared to low energy faceted voids exhibiting different relative proportions of each family of terminating surfaces. It is found that the equilibrium Wulff shape does not represent the lowest energy morphology for nm void sizes at temperatures between 300 K and 1200 K. Furthermore, the lowest energy faceted voids are slightly more energetically favourable than spherical voids, and as Xe is added, and bubble pressure increases, the faceted morphology becomes even more favourable than the spherical shape.

36 MATERIALS SCIENCE↗