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At least 1,099 records · Page 61
All sourcesNASA NTRSDOE OSTI
NASA NTRS2003

Density Anomalies in the Mantle and the Gravitational Core-Mantle Interaction

Seismic studies suggest that the bulk of the mantle is heterogeneous, with density variations in depth as well as in horizontal directions (latitude and longitude). This density variation produces a three- dimensional gravity field throughout the Earth. On the other hand, the core density also varies in both time and space, due to convective core flow. Consequently, the fluid outer core and the solid mantle interact gravitationally due to the mass anomalies in both regions. This gravitational core-mantle interaction could play a significant role in exchange of angular momentum between the core and the mantle, and thus the change in Earth's rotation on time scales of decades and longer. Aiming at estimating the significance of the gravitational core-mantle interaction on Earth's rotation variation, we introduce in our MoSST core dynamics model a heterogeneous mantle, with a density distribution derived from seismic results. In this model, the core convection is driven by the buoyancy forces. And the density variation is determined dynamically with the convection. Numerical simulation is carried out with different parameter values, intending to extrapolate numerical results for geophysical implications.

Kuang, Weijia↗
DOE OSTI2018

Ab Initio Study of the Polarization, Electronic, Magnetic, and Optical Properties of Perovskite SrMO{sub 3} (M = Fe, Mn) Crystals and Thin Films Containing Magnetic Ions

The magnetic, electronic, and polarization properties of the SrFeO{sub 3} and SrMnO{sub 3} compounds with a perovskite structure are calculated using the density functional theory in the bulk and thin-film states. A ferroelectric instability is found to be absent in the bulk state, and the polar mode is softened in the thin-film state of SrMnO{sub 3} in the presence of tensile stresses in the substrate. As a result, a polar phase with a polarization of 23 μC/cm{sup 2} appears, which agrees with experimental data. The study of the magnetic and electronic properties demonstrates the existence of G-type antiferromagnetic ordering in SrMnO{sub 3} and the appearance of a dielectric gap of about 1.5 eV in its thin film. A ferromagnetic phase with metallic conduction in both the bulk and thin-film states is detected in SrFeO{sub 3}.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
NASA NTRS1975

Electron and proton damage coefficients in low-resistivity silicon

The electron and proton damage coefficients for low resistivity p-type boron-doped silicon were determined from minority-carrier lifetime measurements on bulk material and diffusion length measurements on solar cells. The bulk samples were irradiated with electrons at three energy levels (0.5, 1.5, and 2.5 MeV) using a Dynamitron. Lifetime measurements were made with a steady-state photoconductivity apparatus, and comparison measurements of diffusion length were obtained using the steady-state surface photovoltage method (Goodman, 1961). The diffusion-length damage coefficients increased with decreasing resistivity for boron-doped silicon; this dependence can be qualitatively accounted for using a two-level Hall-Shockley-Read model. The damage coefficients for solar cells were larger than for their bulk-material counterparts. The damage coefficient was apparently independent of the dislocation density in the 0.1 ohm-cm bulk samples and solar cells investigated.

Srour, J. R.↗
DOE OSTI2017

Direct Laser Writing of Low-Density Interdigitated Foams for Plasma Drive Shaping [Direct Laser Writing of Low Density Nanostitched Foams for Plasma Drive Shaping]

Monolithic porous bulk materials have many promising applications ranging from energy storage and catalysis to high energy density physics. High resolution additive manufacturing techniques, such as direct laser writing via two photon polymerization (DLW-TPP), now enable the fabrication of highly porous microlattices with deterministic morphology control. In this work, DLW-TPP is used to print millimeter-sized foam reservoirs (down to 0.06 g cm –3 ) with tailored density-gradient profiles, where density is varied by over an order of magnitude (for instance from 0.6 to 0.06 g cm –3 ) along a length of <100 µm. Taking full advantage of this technology, however, is a multiscale materials design problem that requires detailed understanding of how the different length scales, from the molecular level to the macroscopic dimensions, affect each other. The design of these 3D-printed foams is based on the brickwork arrangement of 100 × 100 × 16 µm 3 log-pile blocks constructed from sub-micrometer scale features. A block-to-block interdigitated stitching strategy is introduced for obtaining high density uniformity at all length scales. Lastly, these materials are used to shape plasma-piston drives during ramp-compression of targets under high energy density conditions created at the OMEGA Laser Facility.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Zirconia and hafnia polymorphs: Ground-state structural properties from diffusion Monte Carlo

Zirconia (zirconium dioxide) and hafnia (hafnium dioxide) are binary oxides used in a range of applications. Because zirconium and hafnium are chemically equivalent, they have three similar polymorphs, and it is important to understand the properties and energetics of these polymorphs. However, while density functional theory calculations can get the correct energetic ordering, the energy differences between polymorphs depend very much on the specific density functional theory approach, as do other quantities such as lattice constants and bulk modulus. We have used highly accurate quantum Monte Carlo simulations to model the three zirconia and hafnia polymorphs. We compare our results for structural parameters, bulk modulus, and cohesive energy with results obtained from density functional theory calculations. We also discuss comparisons of our results with existing experimental data, in particular for structural parameters where extrapolation to zero temperature can be attempted. We hope our results of structural parameters as well as for cohesive energy and bulk modulus can serve as benchmarks for density-functional theory based calculations and as a guidance for future experiments.

36 MATERIALS SCIENCE↗
DOE OSTI2022

Bulk Viscosity of Relativistic npeμ Matter in Neutron-Star Mergers

We discuss the bulk viscosity of hot and dense npeμ matter arising from weak-interaction direct Urca processes. We consider two regimes of interest: (a) the neutrino-transparent regime with T ≤ T tr (T tr ≃ 5 ÷ 10 MeV is the neutrino-trapping temperature); and (b) the neutrino-trapped regime with T ≥ T tr . Nuclear matter is modeled in relativistic density functional approach with density-dependent parametrization DDME2. The maximum of the bulk viscosity is achieved at temperatures T ≃ 5 ÷ 6 MeV in the neutrino-transparent regime, then it drops rapidly at higher temperatures where neutrino-trapping occurs. As an astrophysical application, we estimate the damping timescales of density oscillations by the bulk viscosity in neutron star mergers and find that, e.g., at the oscillation frequency f = 10 kHz, the damping will be very efficient at temperatures 4 ≤ T ≤ 7 MeV where the bulk viscosity might affect the evolution of the post-merger object.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1993

Physical and chemical properties of some new perfluoropolyalkylether lubricants prepared by direct fluorination

A series of perfluoropolyalkylether (PFPAE) fluids was synthesized by direct fluorination. Viscosity-temperature properties, oxidation stabilities, oxidation-corrosion properties, bulk modulus, lubricity, surface tension and density were measured. It was shown that as the carbon to oxygen ratio in the polymer repeating unit decreases, the viscometric properties improve, the fluids may become poorer boundary lubricants, the bulk modulus increases, the surface tension increases and the fluid density increases. The presence of difluoromethylene oxide units in the polymer does not significantly lower the oxidation and oxidation-corrosion stabilities as long as the difluoromethylene oxide units are separated by other units.

Jones, W. R., Jr.↗
DOE OSTI2016

Ab-initio study of electronic structure and elastic properties of ZrC

The electronic and elastic properties of ZrC have been investigated using the linear combination of atomic orbitals method within the framework of density functional theory. Different exchange-correlation functionals are taken into account within generalized gradient approximation. We have computed energy bands, density of states, elastic constants, bulk modulus, shear modulus, Young’s modulus, Poisson’s ratio, lattice parameters and pressure derivative of the bulk modulus by calculating ground state energy of the rock salt structure type ZrC.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2014

Molecular-dynamics simulations of thin polyisoprene films confined between amorphous silica substrates

Constant temperature–constant pressure (NpT) molecular-dynamics computer simulations have been carried out for the united-atom model of a non-crosslinked (1,4) cis-polyisoprene (PI) melt confined between two amorphous, fully coordinated silica surfaces. The Lennard-Jones 12-6 potential was implemented to describe the polymer–silica interactions. The thickness H of the produced PI–silica film has been varied in a wide range, 1 < H/R{sub g} < 8, where R{sub g} is the individual PI chain radius of gyration measured under the imposed confinement. After a thorough equilibration, the PI film stratified structure and polymer segmental dynamics have been studied. The chain structure in the middle of the films resembles that in a corresponding bulk, but the polymer-density profile shows a pronounced ordering of the polymer segments in the vicinity of silica surfaces; this ordering disappears toward the film middles. Tremendous slowing down of the polymer segmental dynamics has been observed in the film surface layers, with the segmental relaxation more than 150 times slower as compared to that in a PI bulk. This effect increases with decreasing the polymer-film thickness. The segmental relaxation in the PI film middles shows additional relaxation process which is absent in a PI bulk. Even though there are fast relaxation processes in the film middle, its overall relaxation is slower as compared to that in a bulk sample. The interpretation of the results in terms of polymer glassy bridges has been discussed.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2015

Doping effect of nano-Ho{sub 2}O{sub 3} and naphthalene in MgB{sub 2} superconductor prepared by powder-in-sealed-tube method

The effect on crystal structure, critical temperature (T{sub C}), and critical current density (J{sub C}) of bulk MgB{sub 2} doped with nano-Ho{sub 2}O{sub 3} and naphthalene was studied. Among all the samples studied, the sample doped with 2.5 wt. % nano-Ho{sub 2}O{sub 3} have shown the best field dependent critical current density [J{sub C}(H)], i.e., 0.77 × 10{sup 5 }A/cm{sup 2} at 2 T and 10 K. While naphthalene doped MgB{sub 2} sample has shown the least J{sub C}(H) characteristics. The improved J{sub C}(H) characteristics in the nano-Ho{sub 2}O{sub 3} doped MgB{sub 2} samples are attributed to improved flux pinning properties due to the formation of HoB{sub 4} and in naphthalene doped MgB{sub 2} samples. The slight lower T{sub C} value (37.01 K) in naphthalene doped samples is attributed to the occurrence of lattice defect by the substitution of carbon at boron site of MgB{sub 2} superconductor. Lower ΔT{sub C} value implies the lesser anisotropy in all the synthesized samples. The flux pinning force density (F{sub P}/F{sub Pmax}) curves are theoretically analyzed using Dew-Hughes model. The result revealed that point pinning is the dominant pinning mechanism for nano-Ho{sub 2}O{sub 3} doped MgB{sub 2} samples, while, surface and grain boundary pinning become dominant with increasing naphthalene addition in nano-Ho{sub 2}O{sub 3} doped MgB{sub 2} samples.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2021

East River Watershed Stable Water Isotope Data in Precipitation, Snowpack and Snowmelt 2016-2020

Stable water isotopes (d18O, d2H and d-excess) are important tracers in hydrologic research to understand water partitioning between vegetation, groundwater, and runoff but are rarely applied to large watersheds with persistent snowpack and complex topopgraphy. Data were collected for the Lawrence Berkeley National Laboratory Watershed Function Science Focus Area supported by the U.S Department of Energy in the East River, CO Hydrologic Unit Code (140200010) with limited data also collected in adjacent watersheds Ohio Creek and Taylor River. Data are provided in csv and includes isotopic information for precipitation (years 2014-2016), snowmelt (years 2016-2017) and snowpits (years 2016-2020). Snowpit data contain depth resolved information at 10 cm intervals for density, snow water equivalent (SWE) and stable water isotopes. Bulk isotopic data for 86 snowpits contain depth, SWE, density and SWE-weighted isotope values. Sampling locations and elevations are provided within the data files, while kmz files are provided to view sampling locations using Google Earth software.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Microporous structure in silicone polymers with polylactic acid and polyethylene glycol microspheres: Synthesis and characterization

Porosity in polymer parts could improve mechanical properties while reducing weight and density. Individual pores must be small enough that bulk mechanical properties are retained but significant enough to reduce the density of the material. Filler materials can be incorporated into polymer matrices and removed to create voids. Here, this paper focuses on creating spherical pores in silicone matrices by inserting and removing core materials or fillers during post-cure. A method was developed to incorporate pore formers into an uncured polymer resin and remove the pore former materials from the matrix. Polyethylene glycol (PEG) and polylactic acid (PLA) microspheres were created and incorporated into silicone matrices as pore formers. Microspheres with controllable size distributions were formed via an emulsion formation. Microspheres are removed from the matrix by solvent extraction and calcination. Thermogravimetric Analysis (TGA), Dynamic Mechanical Analysis (DMA), and optical imaging characterize and determine the successful creation of micropores in the polymer matrices.

36 MATERIALS SCIENCE↗
NASA NTRS1980

Measuring radiation effects on MOS capacitors

Electron injection technique serves as powerful probe of trapped hole distribution after irradiation because it was determined that electrons only annihilate trapped holes. Other effects, such as other electron traps and interface state generation, are negligible in injection range used. Trap cross sections and densities indicate at least three trap species; interfacial species, dominant bulk species determined to tail off from silicon interface, and lower density and cross section species that may be distributed throughout bulk of oxide.

Bakowski, M.↗
DOE OSTI2020

The influence of phonon softening on the superconducting critical temperature of Sn nanostructures

Abstract The increase in superconducting transition temperature (T C ) of Sn nanostructures in comparison to bulk, was studied. Changes in the phonon density of states (PDOS) of the weakly coupled superconductor Sn were analyzed and correlated with the increase in T C measured by magnetometry. The PDOS of all nanostructured samples shows a slightly increased number of low-energy phonon modes and a strong decrease in the number of high-energy phonon modes in comparison to the bulk Sn PDOS. The phonon densities of states, which were determined previously using nuclear resonant inelastic X-ray scattering, were used to calculate the superconducting transition temperature using the Allen-Dynes-McMillan (ADMM) formalism. Both the calculated as well as the experimentally determined values of T C show an increase compared to the bulk superconducting transition temperature. The good agreement between these values indicates that phonon softening has a major influence on the superconducting transition temperature of Sn nanostructures. The influence of electron confinement effects appears to be minor in these systems.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2016

Si clusters are more metallic than bulk Si

Dipole polarizabilities were computed using density functional theory for silicon clusters over a broad range of sizes up to N = 147 atoms. The calculated total effective polarizabilities, which include contributions from permanent dipole moments of the clusters, are in very good agreement with recently measured values. We show that the permanent dipole contributions are most important for clusters in the intermediate size range and that the measured polarizabilities can be used to distinguish between energetically nearly degenerate cluster isomers at these sizes. We decompose the computed total polarizabilities into the so-called dipole and charge transfer contributions, $α^p$ and $α^q$, using a sitespecific analysis. When the per-atom values of these quantities are plotted against $N^{-1/3}$, clear linear trends emerge that can be extrapolated to the large size limit ($N^{-1/3}$ → 0), resulting in a value for $\frac{α}{N}$ of 30.5 bohrs 3 /atom that is significantly larger than the per-atom polarizability of semiconducting bulk Si, 25.04 bohrs 3 /atom. This indicates that Si clusters possess a higher degree of metallicity than bulk Si, a conclusion that is consistent with the strong electrostatic screening of the cluster interiors made evident by the analysis of the calculated atomic polarizabilities.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2020

Charge density wave modulation in superconducting BaPb O 3 / BaBi O 3 superlattices

The isotropic, nonmagnetic doped BaBiO 3 superconductors maintain some similarities to high-T c cuprates, while also providing a cleaner system for isolating charge density wave (CDW) physics that commonly competes with superconductivity. Artificial layered superlattices offer the possibility of engineering the interaction between superconductivity and CDW. Here we stabilize a low-temperature, fluctuating short-range CDW order by using artificially layered epitaxial (BaPbO 3 ) 3m /(BaBiO 3 ) m (m = 1-10 unit cells) superlattices that are not present in the optimally doped BaPb 0.75 Bi 0.25 O 3 alloy with the same overall chemical formula. Charge transfer from BaBiO 3 to BaPbO 3 effectively dopes the former and suppresses the long-range CDW; however, as the short-range CDW fluctuations strengthen at low temperatures charge appears to localize and superconductivity is weakened. The monolayer structural control demonstrated here provides compelling implications to access controllable, local density wave orders absent in bulk alloys and manipulate phase competition in unconventional superconductors.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2011

THE COSMOLOGICAL BULK FLOW: CONSISTENCY WITH {Lambda}CDM AND z {approx} 0 CONSTRAINTS ON {sigma}{sub 8} AND {gamma}

We derive estimates for the cosmological bulk flow from the SFI++ Tully-Fisher (TF) catalog. For a sphere of radius 40 h{sup -1} Mpc centered on the Milky Way, we derive a bulk flow of 333 {+-} 38 km s{sup -1} toward Galactic (l, b) = (276 deg., 14 deg.) within a 3{sup 0} 1{sigma} error. Within a radius of 100h{sup -1} Mpc we get 257 {+-} 44 km s{sup -1} toward (l, b) = (279 deg., 10 deg.) within a 6 deg. error. These directions are at 40 deg. to the Supergalactic plane, close to the apex of the motion of the Local Group of galaxies after the Virgocentric infall correction. Our findings are consistent with the {Lambda}CDM model with the latest Wilkinson Microwave Anisotropy Probe (WMAP) best-fit cosmological parameters, but the bulk flow allows independent constraints. For the WMAP-inferred Hubble parameter h = 0.71 and baryonic mean density parameter {Omega}{sub b} = 0.0449, the constraint from the bulk flow on the matter density, {Omega}{sub m}, the normalization of the density fluctuations, {sigma}{sub 8}, and the growth index, {gamma}, can be expressed as {sigma}{sub 8}{Omega}{sup {gamma}-0.55}{sub m}({Omega}{sub m}/0.266){sup 0.28} = 0.86 {+-} 0.11 (for {Omega}{sub m} {approx} 0.266). Fixing {sigma}{sub 8} = 0.8 and {Omega}{sub m} = 0.266 as favored by WMAP, we get {gamma} = 0.495 {+-} 0.096. The constraint derived here rules out popular Dvali-Gabadadze-Porrati models at more than the 99% confidence level. Our results are based on the All Space Constrained Estimate (ACSE) model which reconstructs the bulk flow from an all space three-dimensional peculiar velocity field constrained to match the TF measurements. At large distances, ASCE generates a robust bulk flow from the SFI++ survey that is insensitive to the assumed prior. For comparison, a standard straightforward maximum likelihood estimate leads to very similar results.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2018

Demonstration of fast-electron populations in a low-pressure, low-power, magnetized RF plasma source

Using x-ray spectroscopy, we demonstrate the existence of 0.3–6 keV electrons in a low-pressure, low-power, magnetized plasma source, heated by an external radio-frequency antenna located at one end of an axisymmetric tandem mirror. X-ray measurements on low-bulk-temperature, T e,b ~ 4 eV, hydrogen, neon, argon, and gas-mixture plasmas show spectra with high-energy tails having a near-Maxwellian form with T e,f up to 650 eV. Furthermore, the fast electrons producing these x-rays have densities in the range of 10 7 –10 9 cm –3 0.01%–1% of the bulk plasma density (up to 3 × 10 11 cm –3 ), and so carry a significant fraction of the plasma energy and represent an important mechanism relevant to power coupling and heat flow in similar plasma sources.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗