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At least 667 records · Page 37
All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

The hierarchical energy landscape of screw dislocation motion in refractory high-entropy alloys

High-entropy alloys (HEAs) with concentrated solid solutions are conceived to possess a rugged atomic and energy landscape in which dislocation motion necessarily proceeds to accommodate mechanical deformation. Fundamental questions remain as to how rough the energy landscape is and to what extent it can be influenced by the local ordering of their constituent elements. Here, we construct and report the potential energy landscape (PEL) governing screw dislocation motion in refractory HEAs that reveals a hierarchical and multilevel structure with a collection of small basins nested in large metabasin. This striking feature pertaining to HEAs exerts a trapping force and back stress on saddle point activations, retarding dislocation movement. Further, by introducing chemical short-range order, the energy landscape is smoothed but skewed to different degrees that shifts the rate-liming process from kink-glide to kink-pair nucleation. The chemical disorder-roughened PEL in HEAs, analogous to structural disorder induced in metallic glasses, signifies the role of various barrier-hopping processes underlying the extraordinary mechanical behaviors of the two distinct groups of materials.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Atomic Structure, Dynamics, Changes in Chemical Bonding and Semiconductor-Metal Transition in Sb 2 Se 3 : A Remarkable Material for Quantum Networks and Energy Applications

Antimony sesquiselenide has become an outstanding functional material for photovoltaics, energy storage and transformation, memory and photonic applications. Sb 2 Se 3 is one of the most successful emerging solar light absorbers and has also been identified as a highly promising ultralow-loss phase-change material (PCM) for next-generation coherent nanophotonic processors, photonic tensor cores, quantum and neuromorphic networks. Unlike benchmark telluride PCMs, Sb 2 Se 3 features a quasi-one-dimensional (1D) crystalline structure consisting of (Sb 4 Se 6 ) ∞ ribbons, lacks the typical PCM chemical bonding, and undergoes an extended semiconductor-metal transition above the melting point. Consequently, the origin of high optical contrast between crystalline (SET) and amorphous (RESET) logic states remains elusive and presents a significant challenge. Using high-energy X-ray diffraction and Raman spectroscopy over a wide temperature range, supported by first-principles simulations and complemented by thermal, optical and electrical measurements, as well as by 121 Sb-Mossbauer spectroscopy, the quasi-1D network of orthorhombic antimony sesquiselenide was found to undergo significant evolution in amorphous and supercooled Sb 2 Se 3 , leading to lower coordination, shorter interatomic distances and a higher p-electron density on antimony, indicating changes in chemical bonding. The observed novel Sb 2 Se 3 nanocrystalline polymorph, characterized by trigonal antimony coordination and more isolated Sb-Se ribbons, could help reduce multiple trapping defect states in the bandgap, which are typical of orthorhombic Sb 2 Se 3 , thereby enhancing the power-conversion efficiency of photovoltaic devices. Semimetallic and metallic liquid Sb 2 Se 3 exhibit a gradual transformation into a denser 2D and/or 3D network with higher antimony coordination. Localized electron states in the pseudogap are becoming extended, leading to an increase in electronic conductivity σ following the relationship σ ∝ N(E F ) 2 . Liquid Sb 2 Se 3 also appears to be strongly fragile, with a nonmonotonic change in viscosity and higher atomic mobility in the metallic liquid. Furthermore, these results explain extraordinary functionalities of Sb 2 Se 3 for photonic and energy applications.

antimony↗
DOE OSTI2023

Long-pulse high-performance H-mode plasmas achieved on EAST

A record duration of a 310 s H-mode plasma (H 98y2 ~ 1.3, n e /n GW ~ 0.7, f BS > 50%) has been recently achieved on experimental advanced superconducting tokamak (EAST) with metal walls, exploiting the device's improved long-pulse capabilities. The experiment demonstrates good control of tungsten concentration, core/edge MHD stability, and particle and heat exhaust with an ITER-like tungsten divertor and zero injected torque, establishing a milestone on the path to steady-state long-pulse high-performance scenarios in support of ITER and CFETR. Important synergistic effects are leveraged toward this result, which relies purely on radio frequency (RF) powers for heating and current drive (H&CD). On-axis electron cyclotron heating enhances the H&CD efficiency from lower hybrid wave injection, increasing confinement quality and enabling fully non-inductive operation at high density (n e /n GW ~ 70%) and high poloidal beta (β P ~ 2.5). A small-amplitude grassy edge localized mode regime facilitates the RF power coupling to the H-mode edge and reduces divertor sputtering/erosion. The high energy confinement quality (H 98y2 ~ 1.3) is achieved with the experimental and simulated results pointing to the strong effect of Shafranov shift on turbulence. Transport analysis suggests that trapped electron modes dominate in the core region during the record discharge. The detailed physics processes (RF synergy, core-edge integration, confinement properties, etc.) of the steady-state operation will be illustrated in the content. In the future, EAST will aim at accessing more relevant dimensionless parameters to develop long-pulse high-performance plasma toward ITER and CFETR steady-state advanced operation.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS2005

The nakhlite meteorites: Augite-rich igneous rocks from Mars

The seven nakhlite meteorites are augite-rich igneous rocks that formed in flows or shallow intrusions of basaltic magma on Mars. They consist of euhedral to subhedral crystals of augite and olivine (to 1 cm long) in fine-grained mesostases. The augite crystals have homogeneous cores of Mg' = 63% and rims that are normally zoned to iron enrichment. The core-rim zoning is cut by iron-enriched zones along fractures and is replaced locally by ferroan low-Ca pyroxene. The core compositions of the olivines vary inversely with the steepness of their rim zoning - sharp rim zoning goes with the most magnesian cores (Mg' = 42%), homogeneous olivines are the most ferroan. The olivine and augite crystals contain multiphase inclusions representing trapped magma. Among the olivine and augite crystals is mesostasis, composed principally of plagioclase and/or glass, with euhedra of titanomagnetite and many minor minerals. Olivine and mesostasis glass are partially replaced by veinlets and patches of iddingsite, a mixture of smectite clays, iron oxy-hydroxides and carbonate minerals. In the mesostasis are rare patches of a salt alteration assemblage: halite, siderite, and anhydrite/ gypsum. The nakhlites are little shocked, but have been affected chemically and biologically by their residence on Earth. Differences among the chemical compositions of the nakhlites can be ascribed mostly to different proportions of augite, olivine, and mesostasis. Compared to common basalts, they are rich in Ca, strongly depleted in Al, and enriched in magmaphile (incompatible) elements, including the LREE. Nakhlites contain little pre-terrestrial organic matter. Oxygen isotope ratios are not terrestrial, and are different in anhydrous silicates and in iddingsite. The alteration assemblages all have heavy oxygen and heavy carbon, while D/H values are extreme and scattered. Igneous sulfur had a solar-system isotopic ratio, but in most minerals was altered to higher and lower values. High precision analyses show mass-independent fractionations of S isotopes. Nitrogen and noble gases are complex and represent three components: two mantle sources (Chas-E and Chas-S), and fractionated Martian atmosphere. The nakhlites are igneous cumulate rocks, formed from basaltic magma at approx.1.3 Ga, containing excess crystals over what would form from pure magma. After accumulation of their augite and olivine crystals, they were affected (to various degrees) by crystallization of the magma, element diffusion among minerals and magma, chemical reactions among minerals and magma, magma movement among the crystals, and post-igneous chemical equilibration. The extent of these modifications varies, from least to greatest, in the order: MIL03346, NWA817, Y000593, Nakhla = Governador Valadares, Lafayette, and NWA998. Chemical, isotopic, and chronologic data confirm that the nakhlites formed on Mars, most likely in thick lava flows or shallow intrusions. Their crystallization ages, referenced to crater count chronologies for Mars, suggest that the nakhlites formed on the large volcanic constructs of Tharsis, Elysium, or Syrtis Major. The nakhlites were suffused with liquid water, probably at approx.620 ma. This water dissolved olivine and mesostasis glass, and deposited iddingsite and salt minerals in their places. The nakhlites were ejected from Mars at approx.10.75Ma by an asteroid impact and fell to Earth within the last 10,000 years. Although the nakhlites are enriched in incompatible elements, their source mantle was strongly depleted. This depletion event was ancient, as the nakhlites source mantle was fractionated while short-lived radionuclides (e.g., t(sub 1/2 = 9 my) were still active. This differentiation event may have been core formation coupled with a magma ocean, as is inferred for the moon.

Treiman, Allan H.↗
DOE OSTI2022

Fast nonlinear iterative solver for an implicit, energy-conserving, asymptotic-preserving charged-particle orbit integrator

Here recently, an asymptotic-preserving (AP) particle orbit integrator has been proposed with remarkable properties including exact energy conservation, the ability to capture of all first-order drifts (including the ∇B-drift), the ability to capture trapped-passing boundaries with parallel velocity extremely close to the critical velocity, and the ability to transition from strongly to weakly magnetized spatial regions. The new AP orbit integrator is implicit, employing a Crank-Nicolson (CN) temporal discretization to ensure exact energy conservation. This, in turn, requires a local nonlinear iteration involving particle velocities and positions, and the local electromagnetic fields, to obtain the new-time solution. Ref. [1] did not attempt to provide an efficient solver for this system, and employed a brute-force GMRES-driven Jacobian-free Newton-Krylov (JFNK) solver to invert the particle orbit equations at every timestep for expediency. While JFNK is robust and reliable, it is also expensive and very intrusive for practical implementations of the method (it requires having the JFNK machinery available and solving a 6 x 6 Jacobian system iteratively once per iteration per particle).

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2025

Magnetic geometry effects on turbulent density fluctuations in Wendelstein 7-X

Line-integrated density fluctuation measurements from the core of the optimised stellarator Wendelstein 7-X (W7-X) are studied in the context of magnetic field geometry changes. The amplitude as well as the spectral distribution of fluctuations is affected by varying the magnetic field configuration. Weaker turbulent fluctuations are observed in configurations with higher rotational transform and lower magnetic mirror depth. Simulations with the gyrokinetic codes stella and GENE-3D are used to investigate the role of magnetic geometry for the experimental observations. The stabilising effect of the high rational transform configuration is reproduced by simulations and can be associated with stronger shaping of the magnetic field. This leads to increased finite Larmor radius and local shear effects, which limit the toroidal extent of ion temperature gradient (ITG) modes. For W7-X configurations with higher magnetic mirror depth, gyrokinetic theory and simulations predict weaker fluctuations, since they are closer to having the maximum-J property, which has a stabilising effect on trapped-electron mode and ITG. The opposite trend is observed experimentally, which can therefore not be explained by geometry effects on turbulence alone.

Wendelstein-7X↗
NASA NTRS1990

Io's atmosphere from microwave detection SO2

The microwave detection of SO2 at 222 GHz in Io's atmosphere is reported. The observations imply an SO2 surface pressure of 4-35 nanobars, covering 3-15 percent of the surface on both leading and trailing sides of Io when illuminated by the sun. This supports atmospheric models in which the partial pressure of SO2 at the surface is determined by the Io surface temperature, favoring, in particular, the 'albedo cold-trap' models. The failure to detect H2S at 169 GHz suggests that the pressure of this gas is probably below 10 to the -10th bar. These results, taken together with Pioneer ionospheric data, suggest that an atmospheric gas other than SO2 is present. It is proposed that the locally buffered SO2 atmosphere coexists with a background atmosphere of oxygen with a partial surface pressure of about 20 nanobars.

Lellouch, Emmanuel↗
NASA NTRS1975

Differential spectra and phase space densities of trapped electrons at Jupiter

Using Pioneer 10 data, differential spectra and phase-space densities have been constructed for trapped electrons at Jupiter. These quantities should assist in calculating synchrotron radiation from these particles and in evaluating the diffusion mechanisms that accelerate the particles. Absorption by the moons Io and Europa is evident, and injection by Io is demonstrated by a density peak in phase space, which demands a local source. There is also a rapid decrease in density between the moons, which could call for either a local loss mechanism or nonlocal losses fed by diffusion.

Mcilwain, C. E.↗
NASA NTRS1986

Wave and plasma observations during a compressional Pc 5 wave event August 10, 1982

Magnetometer and thermal plasma instruments on the polar-orbiting Dynamics Explorer 1 satellite observed a small-amplitude ultralow frequency pulsation event at the outer edge of the plasmapause near the geomagnetic equator in the midafternoon sector on August 10, 1982, during the recovery phase of a magnetic storm. Transverse pulsations of 30-50 s period were observed throughout the event, and a 270-s period, purely compressional Pc 5 pulsation with several shifts in phase occurred within + or - 5 deg of the geomagnetic equator. Electric fields and the motion of thermal ions appeared to be in quadrature with pulsations in magnetic field magnitude throughout the event. This suggests that the net Poynting flux for the compressional waves was zero, consistent with their being standing waves. Large fluxes of trapped 90 deg pitch angle 10-eV protons, also symmetric about the geomagnetic equator, were observed in conjunction with the waves. These may serve as a source of free energy for the pulsations. These observations lend support to recent studies suggesting that many dayside compressional wave events are related to localized field line resonance near plasmapauselike boundaries, but also include features that cannot be explained by existing theories.

Engebretson, M. J.↗
NASA NTRS2020

The Roughness Properties of Small Ice-Bearing Craters at the South Pole of the Moon: Implications for Accessing Fresh Water Ice in Future Surface Operations

The lunar poles provide a fascinating thermal environment capable of cold-trapping water ice on geologic timescales [1]. While there have been many observations indicating the presence of water ice at the lunar surface [e.g., 2–4], it is still not clear when this ice was delivered to the Moon. The timing of volatile dep-osition provides important constraints on the origin of lunar ice because different delivery mechanisms have been active at different times throughout lunar history. We previously found that some small (<10 km) cra-ters at the south pole of the Moon have morphologies suggestive of relatively young ages, on the basis of crisp crater rims [5]. These craters are too small to date with robust cratering statistics [5], but the possibility of ice in young craters is intriguing because it suggests that there is some recent and perhaps ongoing mechanism that is delivering or redistributing water to polar cold traps. Therefore, understanding if these small, ice-bear-ing craters are indeed young is essential in understand-ing the age and source of volatiles on the Moon. Here we take a new approach to understand the ages of these small polar cold traps: analyzing the roughness properties of small ice-bearing craters. It is well under-stood that impact crater properties (e.g., morphology, rock abundance, and roughness) evolve with time due to a variety of geologic and space-weathering processes [6–11]. Topographic roughness is a measurement of the local deviation from the mean topography, providing a measurement of surface texture, and is a powerful tool for evaluating surface evolution over geologic time [e.g., 11–14]. In this study we analyze the roughness of southern lunar craters (40°S–90°S) from all geologic eras, and determine how the roughness of small (<10 km) ice-bearing craters compare. We discuss the implications of the ages of ice-bearing south polar craters, and potential strategies for accessing fresh ice on the Moon.

Deutsch, Ariel N.↗
DOE OSTI2026

A Prodrug Strategy to Conditionally Trap Therapeutic Payloads for Improved Tumor Retention

Altered extracellular proteolysis has been exploited to selectively activate therapeutics in diseases such as cancer; however, once activated, extracellular drugs can diffuse away, limiting efficacy. We address this challenge by coupling proteolytic activation with membrane tethering to retain drugs within diseased tissue. To accomplish this, we developed “restricted interaction peptides” (RIPs), a delivery platform that leverages elevated proteolytic activity to activate membrane-interacting peptides, localizing cargos near the site of proteolysis. We demonstrate that RIPs can deliver diverse therapeutic cargos, including cytotoxins and radioisotopes. As proof of concept, we engineered “FRIP,” a RIP designed for cleavage by fibroblast activation protein (FAP), an endoprotease upregulated in solid tumors and fibrosis. Efficient P4–P4’ substrate sequences were identified and incorporated into FRIPs. Cell-based studies showed that, upon activation, the peptide adhered to membranes rapidly internalized and successfully delivered therapeutic cargos. Consistent with this, FRIPs delivering MMAE inhibited proliferation in an FAP-dependent manner. Imaging studies confirmed tumor targeting with minimal uptake in normal tissues. Finally, FRIPs delivering MMAE or Cu-67 exhibited potent antitumor effects. These findings establish membrane tethering as a strategy to enhance drug retention.

60 APPLIED LIFE SCIENCES↗
NASA NTRS1985

Trapping of ion conics by downward parallel electric fields

Energetic particle data from electrostatic analyzers aboard the S3-3 satellite indicative of a downward parallel electric field at low altitudes are presented to argue for a causal connection between downward parallel electric fields and ion heating. The data include observations of upward field-aligned electron beams in regions where precipitating electron fluxes are suppressed. Evidence of downward acceleration of ions and locally mirroring ion conics is also presented. It is argued that the presence of a downward electric field may have important consequences for ion conic heating and might in fact be required for the observed heating of ions to several hundred electron volts.

Gorney, D. J.↗
DOE OSTI2016

Interaction of solitons with a string of coupled quantum dots

In this paper, we develop a theory for discrete solitons interaction with a string of coupled quantum dots in view of the local field effects. Discrete nonlinear Schrodinger (DNLS) equations are used to describe the dynamics of the string. Numerical calculations are carried out and results are analyzed with the help of matlab software. With the help of numerical solutions we demonstrate that in the quantum dots string, Rabi oscillations (RO) are self trapped into stable bright Rabi solitons. The Rabi oscillations in different types of nanostructures have potential applications to the elements of quantum logic and quantum memory.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
NASA NTRS1975

High-order magnetic multipoles as a source of gross asymmetry in the distant Jovian magnetosphere

The longitudinal asymmetry of the surface magnetic-field strength at Jupiter causes a longitudinal asymmetry in the equatorial plasma mass density within the Jovian magnetosphere. The rotation of these density variations with the planet causes a diurnal variation of the radial distance on the night side at which the centrifugal stress of the magnetospheric plasma exceeds the local magnetic-field tension. This is approximately the distance at which the magnetic field opens to interplanetary space; we estimate that the opening distance can vary by as much as 14% as a result of the observed surface field asymmetry. Such a diurnal variation of the boundary of the particle trapping region can account for the observed ten-hour modulation of relativistic electrons emitted from Jupiter into interplanetary space.

Dessler, A. J.↗
NASA NTRS1993

An improved linear ion trap physics package

This article describes an improvement in the architecture of the physics package used in the Linear Ion Trap (LIT)-based frequency standard recently developed at JPL. This new design is based on the observation that ions can be moved along the axis of an LIT by applied dc voltages. The state selection and interrogation region can be separated from the more critical microwave resonance region where the multiplied local oscillator signal is compared with the stable atomic transition. This separation relaxes many of the design constraints of the present units. Improvements include increased frequency stability and a substantial reduction in size, mass, and cost of the final frequency standard.

Prestage, J. D.↗
NASA NTRS1996

Secondary particle contribution to LET spectra on LDEF

Four experiments utilizing passive detectors (P0006, P0004, A0015, M0004) were flown on LDEF to study the radiation environment. These experiments have been summarized in a companion paper (Benton et al., 1996). One of the experimental goals was to measure LET spectra at different locations and shielding depths with plastic nuclear track detectors (PNTD). It was found that the LET spectra extended well above the LET cutoff imposed by the geomagnetic field on GCR particle penetration into LEO. The high LET particles detected were mostly short-range (range < 2000 m), indicating that they were secondaries produced locally within the PNTD. The presence of these high LET particle fluences is important for the determination of dose equivalent because of the high Quality Factors (Q) involved. A relatively small fraction of particle fluence can contribute a large fraction of dose equivalent. Short-range, inelastic secondary particles produced by trapped protons in the South Atlantic Anomaly (SAA) were found to be a major contributor to the LET spectra above 100 keV/micrometer. The LET spectra were found to extend beyond the approximately 137 keV/micrometer relativistic GCR Fe peak to over 1000 keV/micrometer. The high LET tail of the LET spectra was measured in CR-39 and polycarbonate PNTDs using different techniques. GCR made a relatively modest contribution to the LET spectra as compared to the contributions from short-range secondary particles and stopping protons. LET spectra intercomparisons were made between LDEF measurements and exposures to 154 MeV accelerated proton beams. The similarities support the role of nuclear interactions by trapped protons as the major source of secondary particles in the PNTDs. Also techniques were employed to reduce the range cutoff for detection of the short-range secondaries to approximately 1 micrometer, so that essentially all secondary particles were included in the LET spectra. This has allowed a more realistic assessment of secondary contribution to dose equivalent. Comparisons of measured and calculated LET spectra have been made that demonstrate the need for more accurate modeling of secondary particles in radiation transport codes. Comparisons include preliminary calculations in which attempts have been made to include secondary particles.

long duration↗
NASA NTRS2010

Low Mass Printable Devices for Energy Capture, Storage, and Use

The energy-efficient, environmentally friendly technology that will be presented is the result of a Space Act Agreement between NthDegree Technologies Worldwide, Inc., and the National Aeronautics and Space Administration's (NASA's) Marshall Space Flight Center (MSFC). The work combines semiconductor and printing technologies to advance lightweight electronic and photonic devices having excellent potential for commercial and exploration applications. Device development involves three projects that relate to energy generation and consumption: (1) a low-mass efficient (low power, low heat emission) micro light-emitting diode (LED) area lighting device; (2) a low-mass omni-directional efficient photovoltaic (PV) device with significantly improved energy capture; and (3) a new approach to building super-capacitors. These three technologies, energy capture, storage, and usage (e.g., lighting), represent a systematic approach for building efficient local micro-grids that are commercially feasible; furthermore, these same technologies, appropriately replacing lighting with lightweight power generation, will be useful for enabling inner planetary missions using smaller launch vehicles and to facilitate surface operations during lunar and planetary surface missions. The PV device model is a two sphere, light trapped sheet approximately 2-mm thick. The model suggests a significant improvement over current thin film systems. For lighting applications, all three technology components are printable in-line by printing sequential layers on a standard screen or flexographic direct impact press using the three-dimensional printing technique (3DFM) patented by NthDegree. One primary contribution to this work in the near term by the MSFC is to test the robustness of prototype devices in the harsh environments that prevail in space and on the lunar surface. It is anticipated that this composite device, of which the lighting component has passed off-gassing testing, will function appropriately in such environments consistent with NASA s exploration missions. Advanced technologies such as this show promise for both space flight and terrestrial applications.

Frazier, Donald O.↗
DOE OSTI2017

Mechanism of Na-Ion Storage in Hard Carbon Anodes Revealed by Heteroatom Doping

Hard carbon is the candidate anode material for the commercialization of Na-ion batteries the batteries that by virtue of being constructed from inexpensive and abundant components open the door for massive scale up of battery-based storage of electrical energy. Holding back the development of these batteries is that a complete understanding of the mechanism of Na-ion storage in hard carbon has remained elusive. Although as an amorphous carbon, hard carbon possesses a subtle and complex structure composed of domains of layered rumpled sheets that have local order resembling graphene within each layer but complete disorder along the c-axis between layers. Here, we present two key discoveries: first that characteristics of hard carbon s structure can be modified systematically by heteroatom doping, and second, that these changes greatly affect Na-ion storage properties, which reveal the mechanisms for Na storage in hard carbon. Specifically, P, S and B doping was used to engineer the density of local defects in graphenic layers, and to modify the spacing between the layers. While opening the interlayer spacing through P or S doping extends the low-voltage capacity plateau, and increasing the defect concentration with P or B doping high first sodiation capacity is achieved. Furthermore, we observe that the highly defective B-doped hard carbon suffers a tremendous irreversible capacity in the first desodiation cycle. Our combined first principles calculations and experimental studies revealed a new trapping mechanism, showing that the high binding energies between B-doping induced defects and Na-ions are responsible for the irreversible capacity. The understanding generated in this work provides a totally new set of guiding principles for materials engineers working to optimize hard carbon for Na-ion battery applications.

25 ENERGY STORAGE↗