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At least 469 records · Page 26

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NASA NTRS1993

Microstructural analysis of the 2195 aluminum-lithium alloy welds

The principal objective of this research was to explain a tendency of 2195 Al-Li alloy to crack at elevated temperature during welding. Therefore, a study was made on the effect of welding and thermal treatment on the microstructure of Al-Li Alloy 2195. The critical roles of precipitates, boundaries, phases, and other features of the microstructure were inferred from the crack propagation paths and the morphology of fracture surface of the alloy with different microstructures. Particular emphasis was placed on the microstructures generated by the welding process and the mechanisms of crack propagation in such structures. Variation of the welding parameters and thermal treatments were used to alter the micro/macro structures, and they were characterized by optical and scanning electron microscopy. A theoretical model is proposed to explain changes in the microstructure of welded material. This model proposes a chemical reaction in which gases from the air (i.e., nitrogen) release hydrogen inside the alloy. Such a reaction could generate large internal stresses capable to induce porosity and crack-like delamination in the material.

Talia, George E.↗

NASA NTRS2017

iPTF Discovery of the Rapid "Turn-On" of a Luminous Quasar

We present a radio-quiet quasar at z = 0.237 discovered ''turning on'' by the intermediate Palomar Transient Factory (iPTF). The transient, iPTF 16bco, was detected by iPTF in the nucleus of a galaxy with an archival Sloan Digital Sky Survey spectrum with weak narrow-line emission characteristic of a low-ionization nuclear emission-line region (LINER). Our follow-up spectra show the dramatic appearance of broad Balmer lines and a power-law continuum characteristic of a luminous (L(sub bol) approx. equal 10(exp 45) erg/s) type 1 quasar 12 yr. later. Our photometric monitoring with PTF from 2009-2012 and serendipitous X-ray observations from the XMM-Newton Slew Survey in 2011 and 2015 constrain the change of state to have occurred less than 500 days before the iPTF detection. An enhanced broad H(alpha)/[O III] (lambda)5007 line ratio in the type 1 state relative to other changing-look quasars also is suggestive of the most rapid change of state yet observed in a quasar. We argue that the greater than 10 increase in Eddington ratio inferred from the brightening in UV and X-ray continuum flux is more likely due to an intrinsic change in the accretion rate of a preexisting accretion disk than an external mechanism such as variable obscuration, microlensing, or the tidal disruption of a star. However, further monitoring will be helpful in better constraining the mechanism driving this change of state. The rapid ''turn-on'' of the quasar is much shorter than the viscous infall timescale of an accretion disk and requires a disk instability that can develop around a approx. equal 10(exp 8)solar mass black hole on timescales less than 1 yr.

Gezari, S.↗

DOE OSTI2021

The Intrinsic Shapes of Low Surface Brightness Galaxies (LSBGs): A Discriminant of LSBG Galaxy Formation Mechanisms

We use the low surface brightness galaxy (LSBG) samples created from the Hyper Suprime-Cam Subaru Strategic Program (781 galaxies), the Dark Energy Survey (20977 galaxies), and the Legacy Survey (selected via H ι detection in the Arecibo Legacy Fast ALFA Survey, 188 galaxies) to infer the intrinsic shape distribution of the LSBG population. To take into account the effect of the surface brightness cuts employed when constructing LSBG samples, we simultaneously model both the projected ellipticity and the apparent surface brightness in our shape inference. We find that the LSBG samples are well characterized by oblate spheroids, with no significant difference between red and blue LSBGs. This inferred shape distribution is in good agreement with similar inferences made for ultra-diffuse cluster galaxy samples, indicating that environment does not play a key role in determining the intrinsic shape of LSBGs. In this study, we also find some evidence that LSBGs are more thickened than similarly massive high surface brightness dwarfs. We compare our results to intrinsic shape measures from contemporary cosmological simulations, and find that the observed LSBG intrinsic shapes place considerable constraints on the formation path of such galaxies. In particular, LSBG production via the migration of star formation to large radii produces intrinsic shapes in good agreement with our observational findings.

79 ASTRONOMY AND ASTROPHYSICS↗

DOE OSTI2025

Unconventional Anomalous Hall Effect in Hexagonal Polar Magnet Y 3 Co 8 Sn 4

A rare realization of unconventional anomalous Hall effect (UAHE) both below and above the magnetic transition temperature (T C ) in a hexagonal noncentrosymmetric magnet Y 3 Co 8 Sn 4 , using a combined experimental and ab initio calculations. Occurrence of such UAHE is mainly attributed to the reciprocal ($\mathscr{KS}$) topology (i.e., the presence of topological Weyl points at/near the Fermi level), along with some contribution from the topological magnetic texture (at low temperatures), as inferred from the measured field-dependent ac susceptibility. The effect of UAHE on the measured transport behavior however evolves differently with temperature above and below T C = 53 K, suggesting different physical mechanism responsible in the two phases. A unique planar ferrimagnetic ordering is found to be the most stable state with ab-plane as the easy plane below T C . The simulated net magnetization and the moment per Co atom agrees fairly well with the experimentally measured values. A reasonably large anomalous Hall conductivity (AHC) is also observed in both the phases (above and below T C ) of the present compound, which is again not so ubiquitous. In conclusion, the results underscore the family of R 3 Co 8 Sn 4 (R = rare earth) polar magnets as a compelling backdrop for exploring the synergy of magnetism and topological non-trivial electronic states, pivotal for spintronic applications.

Density functional theory calculations↗

DOE OSTI2021

The Moderately (D)efficient Enzyme: Catalysis-Related Damage In Vivo and Its Repair

Enzymes have in vivo life spans. Analysis of life spans, i.e., lifetime totals of catalytic turnovers, suggests that nonsurvivable collateral chemical damage from the very reactions that enzymes catalyze is a common but underdiagnosed cause of enzyme death. Analysis also implies that many enzymes are moderately deficient in that their active-site regions are not naturally as hardened against such collateral damage as they could be, leaving room for improvement by rational design or directed evolution. Enzyme life span might also be improved by engineering systems that repair otherwise fatal active-site damage, of which a handful are known and more are inferred to exist. Unfortunately, the data needed to design and execute such improvements are lacking: there are too few measurements of in vivo life span, and existing information about the extent, nature, and mechanisms of active-site damage and repair during normal enzyme operation is too scarce, anecdotal, and speculative to act on. Fortunately, advances in proteomics, metabolomics, cheminformatics, comparative genomics, and structural biochemistry now empower a systematic, data-driven approach for identifying, predicting, and validating instances of active-site damage and its repair. These capabilities would be practically useful in enzyme redesign and improvement of in-use stability and could change our thinking about which enzymes die young in vivo, and why.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2025

Delving into the depths of NGC 3783 with XRISM

We present our study of the X-Ray Imaging and Spectroscopy Mission (XRISM) observation of the Seyfert-1 galaxy NGC 3783. XRISM’s Resolve microcalorimeter has enabled, for the first time, a detailed characterization of the highly ionized outflows in this active galactic nucleus. Our analysis constrains their outflow and turbulent velocities, along with their ionization parameter (ξ) and column density (N H ). The high-resolution Resolve spectrum reveals a distinct series of Fe absorption lines between 6.4 and 7.8 keV, ranging from Fe XVIII to Fe XXVI. At lower energies (1.8−3.3 keV), absorption features from Si, S, and Ar are also detected. Our spectroscopy and photoionization modeling of the time-averaged Resolve spectrum uncovers six outflow components, five of which exhibit relatively narrow absorption lines with outflow velocities ranging from 560 to 1170 km s −1 . In addition, a broad absorption feature is detected, which is consistent with Fe XXVI outflowing at 14 300 km s −1 (0.05 c). The kinetic luminosity of this component is 0.8−3% of the bolometric luminosity. Our analysis of the Resolve spectrum shows that more highly ionized absorption lines are intrinsically broader than those of lower-ionization species, indicating that the turbulent velocity of the six outflow components (ranging from 0 to 3500 km s −1 ) increases with ξ. Furthermore, we find that the column density (N H ) of the outflows generally declines with the ionization parameter up to log ξ = 3.2 but rises beyond this point, suggesting a complex ionization structure. The absorption profile of the Fe XXV resonance line is intriguingly similar to UV absorption lines (Lyα and C IV) observed by the Hubble Space Telescope, from which we infer that the outflows are clumpy in nature. Our XRISM/Resolve results from lower- and higher-ionization regimes support a “hybrid wind” scenario in which the observed outflows have multiple origins and driving mechanisms. We explore various interpretations of our findings within active galactic nucleus wind models.

X-rays: galaxies↗

DOE OSTI2023

Bayesian Inference applied to the Solubility of Phase-3 and Phase-5

This Section covers an introduction to the objectives and techniques used in this analysis. The objectives of the report are given in Subsection 1.1. An introduction to aqueous thermodynamics and how variance might propagate through the relevant thermodynamic equations is given in Subsection 1.2. An introduction to Bayesian inference and its application to thermodynamic modeling is given in Subsection 1.3.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2022

Bayesian Estimation of Oscillator Parameters: Toward Anomaly Detection and Cyber-Physical System Security

Cyber-physical system security presents unique challenges to conventional measurement science and technology. Anomaly detection in software-assisted physical systems, such as those employed in additive manufacturing or in DNA synthesis, is often hampered by the limited available parameter space of the underlying mechanism that is transducing the anomaly. As a result, the formulation of anomaly detection for such systems often leads to inverse or ill-posed problems, requiring statistical treatments. Here, we present Bayesian inference of unknown parameters associated with a generic actuator considered as a representative vital element of a cyber-physical system. Via a series of experimental input-output measurements, a transfer function for the actuator is obtained numerically, which serves as our model for the proposed method. Linear, nonlinear, and delayed dynamics may be assumed for the actuator response. By devising a code-based malicious signal, we study the efficacy of Bayesian inference for its potential to produce a detection, including uncertainty quantification, with a remarkably small number of input data points. Our approach should be adaptable to a variety of real-time cyber-physical anomaly detection scenarios.

47 OTHER INSTRUMENTATION↗

NASA NTRS1979

On the origin of chondrules

A new mechanism for primordial melting of chondrules based upon heating by relativistic electrons accelerated by reconnecting magnetic field lines is discussed. This mechanism is free of the creation-annihilation problem of collisions used for heating. The basic requirements for reconnection are an interplanetary magnetic field with regions of reversals. An early magnetic field is inferred from the paleomagnetism of meteorites and the requirements of solar spin-down, while the field reversals upon which the reconnection is based are a common property of the present epoch solar wind.

Sonett, C. P.↗

NASA NTRS1994

On the vertical thermal structure of Io's atmosphere

A radiative-thermal conduction model for the vertical thermal structure of Io's atmosphere is developed with solar heating by SO2 absorption in UV and near-IR bands and non-local thermodynamic equilibrium (LTE) cooling by SO2 nu(sub 1), nu(sub 2), nu(sub 3), vibrational bands and rotational lines. The model predicts the existence of a mesopause in Io's atmosphere when the surface pressure exceeds approximately 10 nbar. The radiative time constant for establishing a mesosphere/mesopause on Io is only approximately 20 min, whereas the thermospheric radiative time constant is about 1 hr. These time constants are significantly shorter than the diurnal time scale and competitive with dynamic time scales. In the thermosphere when solar UV heating dominates, the asymptotic thermospheric temperature is approximately 270 K, only 140 K greater than the surface temperature because at high altiudes non-LTE cooling by SO2 rotation lines exceeds cooling in the nu(sub 2) virbrational band. Solar-heating-only modles are incapable of generating warm enough atmospheres to satisfy the observational inferences from UV and especially millimeter-wave meausrements. Joule heating driven by the penetration of Jupiter's corotational electric field into Io's conducting ionosphere is demonstrated to be the dominant heating mechanism in the subnanobar regions of Io's atmosphere with tempertures ranging from 150 to 1000 K as a function of decreasing pressure from 1 to 0.1 nbar, The asymoptotic thermospheric temperature can attain a value as high as 1800 K.

Strobel, Darrell F.↗

NASA NTRS2014

Dust Interactions on Small Solar System Bodies and Technology Considerations for Exploration

Small‐bodies such as asteroids and Mars' moons Phobos and Deimos have relatively unknown regolith environments. It is hypothesized that dust preserved in the regolith on the surfaces will have similar mechanical properties to lunar dust because of similar formation processes from micrometeorite bombardment, low relative gravity for slow settling times, and virtually no weathering because there is no atmosphere. This combination of processes infers that small‐body dust particles will be highly angular and retain abrasive properties. The focus of this paper uses the mission architecture and engineering design for an asteroid hopper known as Hedgehog, a spherical spacecraft with several symmetric spikes used to aid with tumbling mobility in a low gravity environment. Dust abrasion considerations are highlighted throughout the paper relating to the lead authors' previous work, but act as an example of one of many important dust or regolith physical properties that need to be considered for future exploration. Measurable regolith properties are summarized in order to identify technologies that may be useful for exploration in terms of scientific return and spacecraft design. Previous instruments are summarized in this paper that could be used on the Hedgehog. Opportunities for hardware payloads are highlighted that include low mass solutions or dualpurpose instruments that can measure regolith or dust properties. Finally, dust mitigation suggestions are made for vehicles of this mobility profile.

Kobrick, Ryan,↗

NASA NTRS2015

Hybrid Glacier Inventory, Gravimetry and Altimetry (HIGA) Mass Balance Product for Greenland and the Canadian Arctic

We present a novel inversion algorithm that generates a mass balance field that is simultaneously consistent with independent observations of glacier inventory derived from optical imagery, cryosphere-attributed mass trends derived from satellite gravimetry, and ice surface elevation trends derived from airborne and satellite altimetry. We use this algorithm to assess mass balance across Greenland and the Canadian Arctic over the Sep-2003 to Oct- 2009 period at 26 kilometers resolution. We evaluate local algorithm-inferred mass balance against forty in situ point observations. This evaluation yields a root mean squared error (RMSE) of 0.15 mWE/a ( 0.15 meters (water equivalent) per annum), and highlights a paucity of in situ observations from regions of high dynamic mass loss and peripheral glaciers. We assess mass losses of 212 plus or minus 67 Gigatons per annum to the Greenland ice sheet proper, 38 Gigatons per annum to peripheral glaciers in Greenland, and 42 Gigatons per annum to glaciers in the Canadian Arctic. These magnitudes of mass loss are dependent on the gravimetry-derived spherical harmonic mass trend we invert. We spatially partition the transient glacier continuity equation by differencing algorithm inferred mass balance from modeled surface mass balance, in order to solve the horizontal divergence of ice flux as a residual. This residual ice dynamic field infers flux divergence (or submergent flow) in the ice sheet accumulation area and at tidewater margins, and flux convergence (or emergent flow) in land-terminating ablation areas, which is consistent with continuum mechanics theory.

Altimetry↗

DOE OSTI2025

Combined TDLAS and chemiluminescence imaging in a flat flame burner operated with NH3/H2 blends

Ammonia is viewed as a viable hydrogen carrier due to favorable storage and transport characteristics. While it can be re-converted to hydrogen at point-of-use via thermal catalytic cracking, direct utilization in combustion systems can result in reduced costs and improved efficiency. A major barrier to this approach is the low flammability and potential for high nitrogen oxide emissions, driven by fuel-bound nitrogen and complex kinetic pathways. While a number of kinetic mechanisms currently exist for simulating ammonia combustion, a major need continues to be direct information about species profiles in easy-to-model systems capable of isolating chemical kinetics from multi-dimensional fluid dynamic effects. This paper reports on recent species measurements made in a flat flame burner using a combined tunable-diode-laser-absorption-spectroscopy (TDLAS) and chemiluminescence imaging approach. Three flame conditions were included representative of NH3/H2 blends, partially cracked NH3 (inc. N2), and 100% NH3 with enhanced air (30% oxygen). Two NIR distributed feedback (DFB) laser diodes were used to determine H2O concentration and temperature (via ratio thermometry) at various radial and axial positions, after which an inverse Abel transform was used to infer centerline values. Companion images were collected using a Princeton Instrument PI-MAX intensified camera equipped with a 105mm UV lens and multiple filter sets targeting OH*, NH*, and NH2* emission. Results were compared to companion Cantera burner-stabilized flame simulations using various kinetic mechanisms. A recent mechanism including excited species chemistry was also included, to investigate whether excited and ground state profiles exhibit significant differences.

ammonia combustion↗

NASA NTRS2004

CME Eruption Onset Observations from EIT and SXT

Why CMEs erupt is a major outstanding puzzle of solar physics. Signatures observable at the earliest stages of eruption onset may hold precious clues about the onset mechanism. We present observations in EUV from SOHO/EIT and in soft X-rays from Yohkoh/SXT of the re-eruption and eruption phases of CME expulsion, along with the eruption's magnetic setting found from SOHO/MDI magnetograms. Most of our events involve clearly-observable filament eruptions and multiple neutral lines, and we use the magnetic settings and motions of the filaments to help infer the geometry and behavior of the associated erupting magnetic fields. Pre-eruption and early-eruption signatures include a relatively slow filament rise prior to eruption, and intensity "dimmings" and brightenings, both in the immediate neighborhood of the "core" (location of greatest magnetic shear) of the erupting fields and at locations remote from the core. These signatures and their relative timings place observational constraints on eruption mechanisms; our recent work has focused on implications for the so-called "tether cutting" and "breakout" models, but the same observational constraints are applicable to any model.

Sterling, A. C.↗

NASA NTRS1979

Martian canyons and African rifts - Structural comparisons and implications

The resistant parts of the canyon walls of the Martian rift complex Valles Marineris have been used to infer an earlier, less eroded reconstruction of the major troughs. The individual canyons are compared with individual rifts of East Africa. When measured in units of planetary radius, Martian canyons show a distribution of lengths nearly identical to those in Africa, both for individual rifts and for compound rift systems. A common mechanism which scales with planetary radius is suggested. Martian canyons are significantly wider than African rifts. This is consistent with the longstanding idea that rift width is related to crustal thickness: most evidence favors a crust on Mars at least 50% thicker than that of Africa. The overall patterns of the rift systems of Africa and Mars are quite different in that the African systems are composed of numerous small faults with highly variable trend. On Mars the trends are less variable; individual scraps are straighter for longer than on earth. The basement and lithosphere of Mars are inferred to be simple, reflecting a relatively inactive tectonic history prior to the formation of the canyonlands.

Frey, H.↗

DOE OSTI2021

Artificial intelligence techniques for integrative structural biology of intrinsically disordered proteins

Here, we outline recent developments in artificial intelligence (AI) and machine learning (ML) techniques for integrative structural biology of intrinsically disordered proteins (IDP) ensembles. IDPs challenge the traditional protein structure-function paradigm by adapting their conformations in response to specific binding partners leading them to mediate diverse, and often complex cellular functions such as biological signaling, self-organization and compartmentalization. Obtaining mechanistic insights into their function can therefore be challenging for traditional structural determination techniques. Often, scientists have to rely on piecemeal evidence drawn from diverse experimental techniques to characterize their functional mechanisms. Multiscale simulations can help bridge critical knowledge gaps about IDP structure-function relationships - however, these techniques also face challenges in resolving emergent phenomena within IDP conformational ensembles. We posit that scalable statistical inference techniques can effectively integrate information gleaned from multiple experimental techniques as well as from simulations, thus providing access to atomistic details of these emergent phenomena.

59 BASIC BIOLOGICAL SCIENCES↗

DOE OSTI2023

Origins of Conformational Heterogeneity in Peptoid Helices Formed by Chiral N -1-Phenylethyl Sidechains

N-substituted glycines (polypeptoids) containing chiral hydrophobic sidechains are known to fold into biomimetic alpha helices. These helix formers often produce conformationally heterogeneous structures and are difficult to characterize at a sub-nanometer resolution. Previously, peptoid N-1-phenylethyl (S)-enantiomer sidechains (Nspe) were inferred from various experiments to form right-handed helices and (R)-enantiomers (Nrpe), left-handed helices. Prior computational work for N(s/r)pe oligomers has struggled to reproduce this trend. Herein, quantum mechanics calculations and molecular dynamics simulations are used to understand the origins of this discrepancy. Results from DFT and molecular mechanics calculations on a variety of Nspe and Nrpe oligomers as a function of chain length are in agreement, showing that Nspe and Nrpe prefer left- and right-handed helices, respectively. Additional metadynamics simulations are used to study Nrpe and Nspe oligomers folding in water. These results show that the free-energy driving forces for assembly into a helical backbone configuration are very small (within ~k B T). Lastly, we compare DFT calculations for other experimentally characterized peptoid sidechains, N(r/s)sb, N(r/s)tbe, and N(r/s)npe. In this analysis, we show that peptoid sidechains determined to be more robust experimentally (tbe and npe) have helical preferences opposite the trend seen in less robust assemblies formed by N(r/s)pe and N(r/s)sb chemistries. Furthermore, the more robust tbe and nnpe favor the (S)-enantiomer to right-handed and the (R)-enantiomers to left-handed helices.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

NASA NTRS1992

The natural thermoluminescence of meteorites. IV - Ordinary chondrites at the Lewis Cliff ice field

Results of natural thermoluminescence (TL) measurements of 302 meteorites from the vicinity of the Lewis Cliff in the Beardmore region of Antarctica are presented in order to identify fragments of a single fall and to elucidate ice sheet movements and the mechanisms by which meteorite concentration occurs at this site. From the distribution of meteorites on the ice, the shape of the fields of 'paired' meteorites, and trends in the natural TL data, it is inferred that there is a western component to the movement of the ice at this location, as well as the previously supposed movement to the north. The western vector explains the concentration of meteorites along the western edge of the ice tongue. These new natural TL data identify several recent falls and several meteorites which probably had unusually small perihelia immediately prior to capture by the earth.

Benoit, Paul H.↗