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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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16 records
All sourcesNASA NTRSDOE OSTI
NASA NTRS1988

The Purdue University Get Away Special II (PUGAS II)

The Purdue University Get Away Special Project (PUGAS) is a student-run organization dedicated to preparing payloads for flight on NASA's space shuttle. The first such payload (PUGAS I) flew on Challenger in 1983. The second payload (PUGAS II) should be ready by the end of 1988 and will include three experiments. The first experiment will involve the production of tin metal foam under microgravity conditions. The second experiment will focus on the desorption of water from carbon-epoxy composite materials. The third experiment will use a solid polymeric material to detect radiation in space.

Olenski, Christopher↗
DOE OSTI2026

High energy X-ray characterization of the microstructure of PuGa alloy samples at macroscopic depths and non-ambient conditions

High energy (95 keV) X-rays were utilized to characterize the microstructure of eight PuGa alloy samples at room temperature and during cooling to ∼10 K. The samples had different Ga content (nominally 0-3.4 at.%), age, and history. A ninth sample, similarly characterized with neutron diffraction, was included to extend the Ga range to 7 at.%. The samples span the range from single phase α (monoclinic) to δ (face-centered cubic) PuGa, as well as a two-phase α′/δ sample. The crystallographic textures, phase fractions, lattice parameters and dislocation densities of each sample were evaluated through distinct analysis techniques. The textures of the samples were modest. In each case, the dislocation densities were relatively high, comparable to cold worked metals and metals exposed to similar radiation dose. At room temperature, the lattice parameters determined in the predominantly single-phase samples were larger than expected based on the nominal Ga concentration. The observed lattice thermal expansions of the single-phase δ samples to 10 K are self-consistent across the samples and consistent with previous measurements reported in the literature. Significantly larger thermal lattice strain is observed in the δ phase of the two-phase material due to mechanical constraint from the α′ phase, which has a three times larger thermal expansion and is much harder than the δ phase. In conclusion, the results demonstrate the unique value of high-energy X-rays for relatively routine microstructural characterization of Pu alloy samples.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PuGa by Materials Project

PuGa crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. there are three inequivalent Pu sites. In the first Pu site, Pu is bonded in a 12-coordinate geometry to eight equivalent Ga atoms. All Pu–Ga bond lengths are 3.13 Å. In the second Pu site, Pu is bonded in a 8-coordinate geometry to eight equivalent Ga atoms. There are four shorter (3.13 Å) and four longer (3.19 Å) Pu–Ga bond lengths. In the third Pu site, Pu is bonded in a 8-coordinate geometry to eight equivalent Ga atoms. There are four shorter (3.12 Å) and four longer (3.20 Å) Pu–Ga bond lengths. Ga is bonded in a distorted q6 geometry to eight Pu and two equivalent Ga atoms. Both Ga–Ga bond lengths are 2.70 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PuGa by Materials Project

PuGa crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Pu sites. In the first Pu site, Pu is bonded in a 5-coordinate geometry to one Pu and eight equivalent Ga atoms. The Pu–Pu bond length is 2.29 Å. There are four shorter (2.93 Å) and four longer (3.25 Å) Pu–Ga bond lengths. In the second Pu site, Pu is bonded in a 8-coordinate geometry to eight equivalent Ga atoms. All Pu–Ga bond lengths are 3.00 Å. Ga is bonded in a 10-coordinate geometry to eight Pu and two equivalent Ga atoms. Both Ga–Ga bond lengths are 2.55 Å.

36 MATERIALS SCIENCE↗
NASA NTRS1987

Multipurpose microcontroller design for PUGAS 2

This paper will report on the past year's work on the development of the microcontroller design for the second Purdue University small self-contained payload. A first report on this effort was given at last year's conference by Ritter (1985). At that time, the project was still at the conceptual stage. Now a specific design has been set, prototyping has begun, and layout of the two-sided circuit board using CAD-techniques is nearing completion. A redesign of the overall concept of the circuit board was done to take advantage of the facilities available to students. An additional controller has been added to take large quantities of data concerning the shuttle environment during takeoff. The importance of setting a design time-line is discussed along with the electrical design considerations given to the controllers.

Weber, David M.↗
DOE OSTI2024

Localized basis set for plutonium

The implementation of optimal strictly localized atomic orbitals basis for plutonium (Pu) using norm-conserving pseudopotential density-functional theory (DFT) is presented. The basis set was applied to the α, β, γ, δ, δ', and ε phases of Pu, δ-Pu surface, and δ-PuGa alloys. The computed properties of the Pu phases and δ-Pu surface were in good agreement with both available experimental data and prior DFT calculations based on plane-wave methodologies. Results for the δ-PuGa alloys were also in good agreement with experimental data. Finally, the reliability of the basis set was further demonstrated by using ab initio molecular dynamics to model the diffusion coefficient and activation barrier for atomic diffusion in a δ-PuGa alloy.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2020

Radiation-Induced Modifications in Copper Oxide Growth

Radiation-induced effects and their influence on oxidation processes were evaluated for their use as a forensic tool for special nuclear material (SNM). A beam of 10 MeV Au³⁺ ions was used to mimic the accumulation of microstructural damage from self-irradiation through the decay of radionuclides. Several copper samples were irradiated as suitable surrogate materials at 200 °C with a flux of 1x10¹² ions/cm·s to damage levels of 5, 10, and 15 displacements per atom (dpa). This corresponds to about 50, 100, and 150 years, respectively, of accumulated α-decay damage in a PuGa alloy assuming a damage rate of 0.1 dpa/year. After irradiation, all samples were exposed to an accelerated aging process induced by thermal treatment at 350 °C for 1 hour in air. This resulted in the growth of a mixed oxide layer (Cu₂O and CuO) which was characterized in detail using several complementary analytical techniques: Scanning Electron Microscopy, Raman spectroscopy, Synchrotron X-ray diffraction (transmission mode), and Grazing Incidence X-ray diffraction. The oxide layer growth of irradiated Cu at 350°C is distinctly modified as a result of the ion irradiation. Most notably, the growth of the CuO phase is suppressed with increasing radiation damage on the Cu substrate, and structural changes occurred in the Cu₂O phase. These results indicate that damage from self-irradiation over time can cause quantifiable modifications in the oxidation process of metals that could be harnessed for their use as a novel forensic tool.

36 MATERIALS SCIENCE↗
DOE OSTI2026

Effects of Composition and Oxidation States on the Structures of Chromium-Containing Sodium Silicate Glasses: Molecular Dynamics Simulations using Machine Learning Interatomic Potentials

Chromium represents a significant challenge for the vitrification of high-level nuclear waste into silicate and borosilicate glasses due to its low solubility and variable oxidation states, which can limit the waste loading due to promotion of crystallization or phase separation during processing. In this study, we modeled chromium containing silicate glasses using molecular dynamics simulations with three machine learning interatomic potentials (MLIPs), MACE, CHGNet, and PFP were employed, to gain insights on glass composition and oxidation states on the structures of these glasses. One of the goals is to evaluate their ability of these MLIPs to accurately represent the general structure of silicate glasses and chromium local environments as a function of chromium oxidation states. Density Functional Theory (DFT) based calculations and experimental data such as neutron structure factors were used to validate the structural models. It was found that the foundation models of all three MLIPs are able to reproduce general structural features of the sodium silicate glass structure consistent with experimental and DFT data, but only CHGNet and PFP can accurately capture the oxidation states and local environment of chromium: tetrahedral for Cr6+ and octahedral for Cr3+. Furthermore, we studied the effect of varying Cr3+/ Cr6+ (Cr3+/Crtotal) ratio and total chromium content using PFP. Our results show that Cr6+ enhances network polymerization by reducing non-bridging oxygens through Na? charge compensation required due to the formation of chromate (CrO42-) species, while Cr³? acts as a network modifier that disrupts connectivity. System size effects on the structural characteristics and chromium environments were also tested using the PFP potential. This work highlights the importance of careful validation on the precision, transferability, and potential of MLIPs for modeling glasses containing transition metal elements that can exist in multiple oxidation states. It is also encouraging to see the foundational models are all three MLFFs are able to reproduce the basic sodium silicate glass structures, while suggesting additional training or refining is needed to improve the description of more complex systems containing transition metals.

Puga, Christina L.↗
DOE OSTI2021

Plant ecological genomics at the limits of life in the Atacama Desert

The Atacama Desert in Chile—hyperarid and with high–ultraviolet irradiance levels—is one of the harshest environments on Earth. Yet, dozens of species grow there, including Atacama-endemic plants. Herein, we establish the Talabre–Lejía transect (TLT) in the Atacama as an unparalleled natural laboratory to study plant adaptation to extreme environmental conditions. We characterized climate, soil, plant, and soil–microbe diversity at 22 sites (every 100 m of altitude) along the TLT over a 10-y period. We quantified drought, nutrient deficiencies, large diurnal temperature oscillations, and pH gradients that define three distinct vegetational belts along the altitudinal cline. Further, we deep-sequenced transcriptomes of 32 dominant plant species spanning the major plant clades, and assessed soil microbes by metabarcoding sequencing. The top-expressed genes in the 32 Atacama species are enriched in stress responses, metabolism, and energy production. Moreover, their root-associated soils are enriched in growth-promoting bacteria, including nitrogen fixers. To identify genes associated with plant adaptation to harsh environments, we compared 32 Atacama species with the 32 closest sequenced species, comprising 70 taxa and 1,686,950 proteins. To perform phylogenomic reconstruction, we concatenated 15,972 ortholog groups into a supermatrix of 8,599,764 amino acids. Using two codon-based methods, we identified 265 candidate positively selected genes (PSGs) in the Atacama plants, 64% of which are located in Pfam domains, supporting their functional relevance. For 59/184 PSGs with an Arabidopsis ortholog, we uncovered functional evidence linking them to plant resilience. As some Atacama plants are closely related to staple crops, these candidate PSGs are a “genetic goldmine” to engineer crop resilience to face climate change.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2024

Biallelic variants in SNUPN cause a limb girdle muscular dystrophy with myofibrillar-like features

Abstract Alterations in RNA-splicing are a molecular hallmark of several neurological diseases, including muscular dystrophies, where mutations in genes involved in RNA metabolism or characterized by alterations in RNA splicing have been described. Here, we present five patients from two unrelated families with a limb-girdle muscular dystrophy (LGMD) phenotype carrying a biallelic variant in SNUPN gene. Snurportin-1, the protein encoded by SNUPN, plays an important role in the nuclear transport of small nuclear ribonucleoproteins (snRNPs), essential components of the spliceosome. We combine deep phenotyping, including clinical features, histopathology and muscle MRI, with functional studies in patient-derived cells and muscle biopsies to demonstrate that variants in SNUPN are the cause of a new type of LGMD according to current definition. Moreover, an in vivo model in Drosophila melanogaster further supports the relevance of Snurportin-1 in muscle. SNUPN patients show a similar phenotype characterized by proximal weakness starting in childhood, restrictive respiratory dysfunction and prominent contractures, although inter-individual variability in terms of severity even in individuals from the same family was found. Muscle biopsy showed myofibrillar-like features consisting of myotilin deposits and Z-disc disorganization. MRI showed predominant impairment of paravertebral, vasti, sartorius, gracilis, peroneal and medial gastrocnemius muscles. Conservation and structural analyses of Snurportin-1 p.Ile309Ser variant suggest an effect in nuclear-cytosol snRNP trafficking. In patient-derived fibroblasts and muscle, cytoplasmic accumulation of snRNP components is observed, while total expression of Snurportin-1 and snRNPs remains unchanged, which demonstrates a functional impact of SNUPN variant in snRNP metabolism. Furthermore, RNA-splicing analysis in patients’ muscle showed widespread splicing deregulation, in particular in genes relevant for muscle development and splicing factors that participate in the early steps of spliceosome assembly. In conclusion, we report that SNUPN variants are a new cause of limb girdle muscular dystrophy with specific clinical, histopathological and imaging features, supporting SNUPN as a new gene to be included in genetic testing of myopathies. These results further support the relevance of splicing-related proteins in muscle disorders.

Iruzubieta, Pablo (ORCID:0000000303316222)↗
NASA NTRS1994

Change in the radiative output of the Sun in 1992 and its effect in the thermosphere

Ground and space measurements of the solar spectral irradiance at radio, visible, UV, and X ray wavelengths show a large decline in the first 6 months of 1992. This sustained drop in the solar output is important in understanding the connection between the emergent magnetic flux on the Sun and the radiative output as well as in understanding the effects of such change in the upper atmosphere of the earth. We present preliminary estimates of the observed changes as the means to spur inquiry into this solar event in the declining phase of solar cycle 22. Typical decreases are 15% in Lyman alpha and 40% in 10.7-cm radio flux. Mass spectrometer and incoherent scatter model calculations at 600 km in the thermosphere indicate a 30% decrease in the temperature and a 3X decrease in the density of the thermosphere near the altitude where both the Upper Atmosphere Research Satellite (UARS) and Hubble Space Telescope (HST) are flying. Decrease of the orbital period of the UARS shows the expected effect of decreasing density at flight altitude. Work in progress indicates that the output change results from the decline in solar magnetic flux to a lower level of activity in the southern hemisphere of the Sun.

White, O. R.↗
NASA NTRS1994

Long-term variations in total solar irradiance

For more than a decade total solar irradiance has been monitored simultaneously from space by different satellites. The detection of total solar irradiance variations by satellite-based experiments during the past decade and a half has stimulated modeling efforts to help identify their causes and to provide estimates of irradiance data, using `proxy' indicators of solar activity, for time intervals when no satellite observations exist. In this paper total solar irradiance observed by the Nimbus-7/Earth Radiation Budget (ERB), Solar Maximum Mission (SMM)/Active Cavity Radiometer Irradiance Monitor (ACRIM) 1, and Upper Atmosphere Research Satellite (UARS)/ACRIM 2 radiometers is modeled with the Photometric Sunspot Index and the Mg II core-to-wing ratio. Since the formation of the Mg II line is very similar to that of the Ca II K line, the Mg core-to-wing ratio, derived from the irradiance observations of the Nimbus-7 and NOAA9 satellites, is used as a proxy for the bright magnetic elements. It is shown that the observed changes in solar irradiance are underestimated by the proxy models at the time of maximum and during the beginning of the declining portion of solar cycle 22 similar to behavior just before the maximum of solar cycle 21. This disagreement between total irradiance observations and their model estimates is indicative of the fact that the underlying physical mechanism of the changes observed in the solar radiative output is not well-understood. Furthermore, the uncertainties in the proxy data used for irradiance modeling and the resulting limitation of the models should be taken into account, especially when the irradiance models are used for climatic studies.

Pap, Judit M.↗
NASA NTRS1997

Long-term variations in total solar and UV irradiances

The variations of total solar and UV irradiances during solar cycles 21 and 22 are compared. The total solar irradiance data used were obtained by the SMM/active cavity radiometer irradiance monitoring (ACRIM) 1, upper atmosphere research satellite (UARS)/ACRIM 2 and ERBS experiments. The space-based irradiance observations are compared to the Mount Wilson Magnetic Plage and Photometric Sunspot Index, which is derived from the area and position of sunspots published by the NOAA World Data Center Solar Geophysical Data Catalog. It is found that the variations in solar UV irradiance were similar during the maximum and minimum of solar cycles 21 and 22. The possible reasons for the differences in the irradiance values during the minima of the two solar cylces are discussed.

Pap, J. M.↗
NASA NTRS1993

Long-Term Variations in Total Solar Irradiance

For more than a decade total solar irradiance has been monitored simultaneously from space by different satellites. The detection of total solar irradiance variations by satellite -based experiments during the past decade and a half has stimulated modeling efforts to help identify their causes and to provide estimates of irradiance data, using "proxy" indicators of solar activity, for the time intervals when no satellite observations exist. In this paper the variations in total solar irradiance observed by the Nimbus-7/ERB, SMM/ACRIM I, and UARS/ACRIM II radiometers are compared to the changes in sunspot darkening and the enhanced emission of bright magnetic elements, including faculae and the magnetic network. Quantitative indices of sunspot darkening have been derived from the area and position of sunspots published in the NOAA-WDC Solar Geophysical Data catalog. The Mg core-to-wing ratio, derived from the irradiance observations of Nimbus-7 and NOAA9 satellites, is used as a proxy for the bright magnetic elements. It has been found that a model, calculated from the Mg II core-to-wing ratio underestimates the observed total irradiance at the time of maximum and during the beginning of the declining portion of solar cycle 22 similar in behaviour just before the maximum of solar cycle 21. Similar results are found using He-line equivalent width and 10.7 cm radio flux which indicates that the current irradiance models are in general not capable to reproducing the changes observed in total solar irradiance.

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