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At least 1,279 records · Page 71

Structure and properties of densified silica glass: characterizing the order within disorder

The broken symmetry in the atomic-scale ordering of glassy versus crystalline solids leads to a daunting challenge to provide suitable metrics for describing the order within disorder, especially on length scales beyond the nearest neighbor that are characterized by rich structural complexity. Here, we address this challenge for silica, a canonical network-forming glass, by using hot versus cold compression to (i) systematically increase the structural ordering after densification and (ii) prepare two glasses with the same high-density but contrasting structures. The structure was measured by high-energy X-ray and neutron diffraction, and atomistic models were generated that reproduce the experimental results. The vibrational and thermodynamic properties of the glasses were probed by using inelastic neutron scattering and calorimetry, respectively. Traditional measures of amorphous structures show relatively subtle changes upon compacting the glass. The method of persistent homology identifies, however, distinct features in the network topology that change as the initially open structure of the glass is collapsed. The results for the same high-density glasses show that the nature of structural disorder does impact the heat capacity and boson peak in the low-frequency dynamical spectra. Densification is discussed in terms of the loss of locally favored tetrahedral structures comprising oxygen-decorated SiSi 4<:sub> tetrahedra.

36 MATERIALS SCIENCE↗

Microstructure dependent shear localization in 316L SS

Shear localization is characterized by the concentration of plastic deformation within narrow bands of material and constitutes the precursor to failure in materials subjected to high strain rates. These bands have been observed experimentally, but classical continuum material models have not been able to fully capture their development. The aim of this research is to investigate the role of microstructural differences in the dynamic shear response of wrought and additively manufactured (AM) 316L SS. Compact Forced Simple Shear specimens for Digital Image Correlation (CFSS-DIC) of wrought and additively manufactured 316L SS were tested on a Split Hopkinson Pressure Bar (SHPB) in conjunction with infrared thermometry measurements. Results indicate that the microstructures of wrought and AM 316L SS exhibit differences that affect the shear response of this materials. In conclusion, CFSS-DIC samples tested on the SHPB did not exhibit recrystallization inside the shear region, fact confirmed by thermometry measurements.

36 MATERIALS SCIENCE↗

Cluster Structures with Machine Learning Support in Neutron Star M-R relations

Neutron stars (NS) are compact objects with strong gravitational fields, and a matter composition subject to extreme physical conditions. The properties of strongly interacting matter at ultra-high densities and temperatures impose a big challenge to our understanding and modelling tools. Some difficulties are critical, since one cannot reproduce such conditions in our laboratories or assess them purely from astronomical observations. The information we have about neutron star interiors are often extracted indirectly, e.g., from the star mass-radius relation. The mass and radius are global quantities and still have a significant uncertainty, which leads to great variability in studying the micro-physics of the neutron star interior. This leaves open many questions in nuclear astrophysics and the suitable equation of state (EoS) of NS. Recently, new observations appear to constrain the mass-radius and consequently has helped to close some open questions. In this work, utilizing modern machine learning techniques, we analyze the NS mass-radius (M-R) relationship for a set of EoS containing a variety of physical models. Our objective is to determine patterns through the M-R data analysis and develop tools to understand the EoS of neutron stars in forthcoming works.

79 ASTRONOMY AND ASTROPHYSICS↗

The hTERT core promoter forms three parallel G-quadruplexes

The structure of the 68 nt sequence with G-quadruplex forming potential within the hTERT promoter is disputed. One model features a structure with three stacked parallel G-quadruplex units, while another features an unusual duplex hairpin structure adjoined to two stacked parallel and antiparallel quadruplexes. We report here the results of an integrated structural biology study designed to distinguish between these possibilities. As part of our study, we designed a sequence with an optimized hairpin structure and show that its biophysical and biochemical properties are inconsistent with the structure formed by the hTERT wild-type sequence. By using circular dichroism, thermal denaturation, nuclear magnetic resonance spectroscopy, analytical ultracentrifugation, small-angle X-ray scattering, molecular dynamics simulations and a DNase I cleavage assay we found that the wild type hTERT core promoter folds into a stacked, three-parallel G-quadruplex structure. The hairpin structure is inconsistent with all of our experimental data obtained with the wild-type sequence. All-atom models for both structures were constructed using molecular dynamics simulations. These models accurately predicted the experimental hydrodynamic properties measured for each structure. We found with certainty that the wild-type hTERT promoter sequence does not form a hairpin structure in solution, but rather folds into a compact stacked three-G-quadruplex conformation.

59 BASIC BIOLOGICAL SCIENCES↗

Design of intrinsically disordered protein variants with diverse structural properties

Intrinsically disordered proteins (IDPs) perform a broad range of functions in biology, suggesting that the ability to design IDPs could help expand the repertoire of proteins with novel functions. Computational design of IDPs with specific conformational properties has, however, been difficult because of their substantial dynamics and structural complexity. We describe a general algorithm for designing IDPs with specific structural properties. We demonstrate the power of the algorithm by generating variants of naturally occurring IDPs that differ in compaction, long-range contacts, and propensity to phase separate. We experimentally tested and validated our designs and analyzed the sequence features that determine conformations. We show how our results are captured by a machine learning model, enabling us to speed up the algorithm. Our work expands the toolbox for computational protein design and will facilitate the design of proteins whose functions exploit the many properties afforded by protein disorder.

Science & Technology - Other Topics↗

Initial Simulations of Empty Room Collapse and Reconsolidation at the Waste Isolation Pilot Plant

The Waste Isolation Pilot Plant (WIPP) is a geologic repository for defense-related nuclear waste. If left undisturbed, the virtually impermeable rock salt surrounding the repository will isolate the nuclear waste from the biosphere. If humans accidentally intrude into the repository in the future, then the likelihood of a radionuclide release to the biosphere will depend significantly on the porosity and permeability of the repository itself. Room ceilings and walls at the WIPP tend to collapse over time, causing rubble piles to form on floors of empty rooms. The surrounding rock formation will gradually compact these rubble piles until they eventually become solid salt, but the length of time for a rubble pile to reach a certain porosity and permeability is unknown. This report details the first efforts to build models to predict the porosity and permeability evolution of an empty room as it closes. Conventional geomechanical numerical methods would struggle to model empty room collapse and rubble pile consolidation, so three different meshless methods, the Immersed Isogeometric Analysis Meshfree, Reproducing Kernel Particle Method (RKPM), and the Conformal Reproducing Kernel method, were assessed. First, the meshless methods and the finite element method each simulated gradual room closure, without ceiling or wall collapse. All three methods produced equivalent room closure predictions with comparable computational speed. Second, the Immersed Isogeometric Analysis Meshfree method and RKPM simulated two-dimensional empty room collapse and rubble pile consolidation. Both methods successfully simulated large viscoplastic deformations, fracture, and rubble pile rearrangement to produce qualitatively realistic results. In addition to geomechanical simulations, the flow channels in damaged salt and crushed salt were measured using micro-computed tomography, and input into a computational fluid dynamics simulation to predict the salt's permeability. Although room for improvement exists, the current simulation approaches appear promising.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

High frequency drive mechanism for an active controls systems aircraft control surface

The mechanism was successfully utilized on a wind tunnel model tested in the transonic blow down tunnel. The mechanism is also applicable to a flying aircraft. Several interrelated mechanical subsystems were utilized, including a low inertia antibacklash drive mechanism for high frequency oscillation and a compact antibacklash drive mechanism for conversion of rotary motion to linear motion.

Smith, H. E.↗

Albedo dichotomy of Rhea - Hapke analysis of Voyager photometry

The Hapke (1986) model has been well fitted to both full-disk and disk-resolved Voyager observations. The low phase angle data indicate a substantial opposition effect, and the Hapke analysis results show that while the regolith compaction parameter for Rhea is definitely larger than for Titania, it is comparable to that of the moon. Photometric differences other than albedo are noted between the leading and trailing hemispheres of the satellite. The albedo map of Rhea presented reproduces the observed lightcurve and demonstrates that no terrain or feature in the trailing hemisphere is as bright as any in the leading hemisphere. A quasi-circular low albedo region near the antiapex of motion is discovered.

Verbiscer, Anne J.↗

Magnetic suspension and balance system advanced study, phase 2

The design improvements for the system encompass 14 or 18 external superconductive coils mounted on a 8 x 8 foot wind tunnel, a superconductive model core magnet on a holmium mandrel to fit an F-16 model, model wings of permanent magnet material Nd2Fe14B, and fiber glass epoxy structure. The Magnetic Suspension and Balance System (MSBS) advanced design is confirmed by the successful construction and test of a full size superconductive model core solenoid with holmium mandrel. The solenoid is 75 cm long and 12.6 cm in diameter and produces 6.1 tesla for a hold time of 47 minutes. An integrated coil system design of a new compact configuration without specific coils for roll or pitch shows promise of simplicity; magnet reductions of 30 percent compared to the most recent 1985 design are possible.

Boom, R. W.↗

Automated assembly of a tetrahedral truss structure using machine vision

The Automated Structures Assembly Laboratory is a unique facility at NASA Langley Research Center used to investigate the robotic assembly of truss structures. Two special-purpose end-effectors have been used to assemble 102 truss members and 12 panels into an 8-meter diameter structure. One end-effector is dedicated to truss member insertion, while a second end-effector is used to install panels. Until recently, the robot motions required to construct the structure were developed iteratively using the facility hardware. Recent work at Langley has resulted in a compact machine vision system capable of providing position information relative to targets on the structure. Use of the vision system to guide the robot from an approach point 10 to 18 inches from the structure, offsetting model inaccuracies, permits robot motion based on calculated points as a first step toward use of preplanned paths from an automated path planner. This paper presents recent work at Langley highlighting the application of the machine vision system during truss member insertion.

Doggett, William R.↗

A broad-band X-ray telescope observation of the black hole candidate LMC X-1

We present the spectrum of the black hole candidate LMC X-1 as observed by the Broad-Band X-ray Telescope (BBXRT). The spectrum cannot be fitted by a simple model, but it requires a soft disk blackbody component and a power-law tail, confirming earlier studies. The blackbody disk component is essentially unchanged since the Ginga measurement in 1987. The implied mass of the compact object is approximately 4.7 (square root of cosine i) solar mass from the soft component fit. We report a 95% confidence detection of weak emission features at approximately 5.1 keV and approximately 7.3 keV. If the 5.1 keV feature is attributed to Fe I K-alpha at 6.39 keV, then the redshift is approximately 0.19. No quasi-periodic behavior is found in the data at this epoch.

Schlegel, Eric M.↗

High Resolution Far-Infrared Studies of Compact Regions in Star-Forming Molecular Clouds

This grant supported the acquisition, analysis and publication of high spatial resolution observations of the far-infrared emission from compact regions of star-forming molecular clouds using the Kuiper Airborne Observatory. We studied regions which are forming stars of low and intermediate mass. In analyzing the data, we utilized radiative transfer codes, incorporating disk models and envelopes, including departures from spherical symmetry. These data, along with data at other wavelengths, were used to probe the distribution of dust temperature and density around young stars and to test theoretical predictions about star formation.

Mundy, Lee G.↗

Parameter Estimation for Compact Binary Coalescence Signals with the First Generation Gravitational-Wave Detector Network

Compact binary systems with neutron stars or black holes are one of the most promising sources for ground-based gravitational-wave detectors. Gravitational radiation encodes rich information about source physics; thus parameter estimation and model selection are crucial analysis steps for any detection candidate events. Detailed models of the anticipated waveforms enable inference on several parameters, such as component masses, spins, sky location and distance, that are essential for new astrophysical studies of these sources. However, accurate measurements of these parameters and discrimination of models describing the underlying physics are complicated by artifacts in the data, uncertainties in the waveform models and in the calibration of the detectors. Here we report such measurements on a selection of simulated signals added either in hardware or software to the data collected by the two LIGO instruments and the Virgo detector during their most recent joint science run, including a blind injection where the signal was not initially revealed to the collaboration. We exemplify the ability to extract information about the source physics on signals that cover the neutron-star and black-hole binary parameter space over the component mass range 1M25M and the full range of spin parameters. The cases reported in this study provide a snapshot of the status of parameter estimation in preparation for the operation of advanced detectors.

Aasi, J.↗

First Detection of X-Ray Polarization from the Accreting Neutron Star 4U 1820−303

This paper reports the first detection of polarization in the X-rays for atoll-source 4U 1820−303, obtained with the Imaging X-ray Polarimetry Explorer (IXPE) at 99.999% confidence level (CL). Simultaneous polarimetric measurements were also performed in the radio with the Australia Telescope Compact Array. The IXPE observations of 4U 1820−303 were coordinated with Swift X-ray Telescope, Neutron Star Interior Composition Explorer, and Nuclear Spectroscopic Telescope Array aiming to obtain an accurate X-ray spectral model covering a broad energy interval. The source shows a significant polarization above 4 keV, with a polarization degree of 2.0% ± 0.5% and a polarization angle of −55° ± 7° in the 4–7 keV energy range, and a polarization degree of 10% ± 2% and a polarization angle of −67° ± 7° in the 7–8 keV energy bin. This polarization also shows a clear energy trend with polarization degree increasing with energy and a hint for a position-angle change of ≃90° at 96% CL around 4 keV. The spectro-polarimetric fit indicates that the accretion disk is polarized orthogonally to the hard spectral component, which is presumably produced in the boundary/spreading layer. We do not detect linear polarization from the radio counterpart, with a 3σ upper limit of 50% at 7.25 GHz.

4U1820-303↗

Design and Implementation of a Parallel Multivariate Ensemble Kalman Filter for the Poseidon Ocean General Circulation Model

A multivariate ensemble Kalman filter (MvEnKF) implemented on a massively parallel computer architecture has been implemented for the Poseidon ocean circulation model and tested with a Pacific Basin model configuration. There are about two million prognostic state-vector variables. Parallelism for the data assimilation step is achieved by regionalization of the background-error covariances that are calculated from the phase-space distribution of the ensemble. Each processing element (PE) collects elements of a matrix measurement functional from nearby PEs. To avoid the introduction of spurious long-range covariances associated with finite ensemble sizes, the background-error covariances are given compact support by means of a Hadamard (element by element) product with a three-dimensional canonical correlation function. The methodology and the MvEnKF configuration are discussed. It is shown that the regionalization of the background covariances; has a negligible impact on the quality of the analyses. The parallel algorithm is very efficient for large numbers of observations but does not scale well beyond 100 PEs at the current model resolution. On a platform with distributed memory, memory rather than speed is the limiting factor.

Keppenne, Christian L.↗

Stratospheric Collection of Dust from Comet 73P/Schwassmann-Wachmann 3

Interplanetary dust particles (IDPs) collected in the stratosphere are unique materials that are compositionally distinct from meteorites. Astronomical observations and dynamical models indicate that both asteroids and short-period comets are significant sources of IDPs. IDPs having fragile, porous structures, unequilibrated, anhydrous mineralogy, and high atmospheric entry velocities are thought to derive from comets, whereas asteroidal IDPs are identified by their compact structure, hydrated mineralogy and low atmospheric entry velocities. Uncertainty remains in the classification of asteroidal and cometary IDPs owing to our limited sampling of comets and the asteroid belt and the complex dynamical histories of most IDPs in space. Most IDPs spend thousands of years in space prior to being accreted by the Earth. During this time, dust particles undergo orbital evolution, including gradual reduction in their perihelion and eccentricity as a result of Poynting-Robertson drag. Planetary encounters may also significantly change their orbital parameters. Consequently, it is generally not possible to identify the specific parent body of a given IDP. However, it has been proposed that it is possible to identify dust from comets that have formed Earth-crossing dust trails. In this case, the dust particles have been in space for such a short period of time (a few decades or less) that their orbits have not significantly changed. Furthermore, these fresh IDPs could be identified in the laboratory from their short space-exposure histories (low solar noble gas abundance and lack of solar flare tracks). NASA flew several dedicated IDP collection missions attempting to collect dust from comet 26P/Grigg-Skjellerup, the best candidate identified. Remarkably, many particles from those collectors exhibit unusual properties, including low abundances of solar noble gases and high abundances of presolar grains. These observations are consistent with the dust particles originating from comet Grigg-Skjellerup (hereafter G-S). This study considers the prospects for collection of dust from comet 73P/Schwassmann-Wachmann 3 (hereafter SW3). SW3 is a small (2 km diameter) Jupiter family comet whose perihelion is close to and just inside the Earth's orbit. The orbit of SW3 is suitable for producing a low-velocity Earth-crossing dust stream and is the likely parent of the Tau Herculid meteor stream. This study complements a previously published model of the SW3 meteor stream that predicted a very low level of activity for grains 100 micron -- 100 mm in size.

Messenger, Scott R.↗

VLA continuum observations of compact H II regions

The VLA interferometer has been used to obtain 5 GHz continuum observations of the galactic H II regions W48, G25.4 - 0.2S, G8.1 + 0.2, and G89.1 + 1.3, at less than 6-arcsec spatial resolution. From the source maps presented, H II region physical parameters are derived and tentative models for the G25.4-0.2S H II region, employing the VLA radio interferometric map and available IR data, are discussed.

Woodward, C. E.↗

Dust supply to close binary systems

Binary systems can be born surrounded by circumbinary discs. The gaseous disc around either of the two stellar companions can have its life extended by the supply of mass arriving from the circumbinary disc. The objective of this study is to investigate the gravitational interactions exerted by a compact and eccentric binary system on the circumbinary and circumprimary discs, and the resulting transport of gas and solids between the disc components. We assume that the gas in the system behaves as a fluid, and we model its evolution by means of high-resolution hydrodynamical simulations. Dust grains are modelled as Lagrangian particles that interact with the gas and the stars. Our models indicate that significant fluxes of gas and dust proceed from the circumbinary disc towards the circumprimary disc. For the applied system parameters, grains of certain sizes are segregated outside the tidal gap generated by the stars. Consequently, the size distribution of the transported dust is not continuous, but presents a gap in the millimetre size range. In close binaries, the lifetime of an isolated circumprimary disc is found to be short, ~10 5 years, because of its low mass. However, because of the influx of gas from beyond the tidal gap, the disc around the primary star can survive much longer, ~10 6 years, as long as gas accretion from the circumbinary disc continues. The supply of solids and the extended lifetime of a circumbinary disc also aids in the possible formation of giant planets. Compared to close binary systems without a circumbinary disc, we expect a higher frequency of singleplanet or multiple-planet systems. Additionally, a planetesimal or debris belt can form in the proximity of the truncation radius of the circumprimary disc and/or around the location of the exterior edge of the tidal gap.

79 ASTRONOMY AND ASTROPHYSICS↗