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At least 1,153 records · Page 64
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

Spinon Fermi Surface in a Cluster Mott Insulator Model on a Triangular Lattice and Possible Application to 1 T –TaS 2

1T-TaS 2 is a cluster Mott insulator on the triangular lattice with 13 Ta atoms forming a star of David cluster as the unit cell. We derive a two-dimensional XXZ spin-1/2 model with a four-spin ring exchange term to describe the effective low energy physics of a monolayer 1T-TaS 2 , where the effective spin-1/2 degrees of freedom arises from the Kramers degenerate spin-orbital states on each star of David. Here, a large scale density matrix renormalization group simulation is further performed on this effective model and we find a gapless spin liquid phase with a spinon Fermi surface at a moderate to large strength region of the four-spin ring exchange term. All peaks in the static spin structure factor are found to be located on the “2k F ” surface of a half-filled spinon on the triangular lattice. Experiments to detect the spinon Fermi surface phase in 1T-TaS 2 are discussed.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
NASA NTRS2004

Failure of Non-Circular Composite Cylinders

In this study, a progressive failure analysis is used to investigate leakage in internally pressurized non-circular composite cylinders. This type of approach accounts for the localized loss of stiffness when material failure occurs at some location in a structure by degrading the local material elastic properties by a certain factor. The manner in which this degradation of material properties takes place depends on the failure modes, which are determined by the application of a failure criterion. The finite-element code STAGS, which has the capability to perform progressive failure analysis using different degradation schemes and failure criteria, is utilized to analyze laboratory scale, graphite-epoxy, elliptical cylinders with quasi-isotropic, circumferentially-stiff, and axially-stiff material orthotropies. The results are divided into two parts. The first part shows that leakage, which is assumed to develop if there is material failure in every layer at some axial and circumferential location within the cylinder, does not occur without failure of fibers. Moreover before fibers begin to fail, only matrix tensile failures, or matrix cracking, takes place, and at least one layer in all three cylinders studied remain uncracked, preventing the formation of a leakage path. That determination is corroborated by the use of different degradation schemes and various failure criteria. Among the degradation schemes investigated are the degradation of different engineering properties, the use of various degradation factors, the recursive or non-recursive degradation of the engineering properties, and the degradation of material properties using different computational approaches. The failure criteria used in the analysis include the noninteractive maximum stress criterion and the interactive Hashin and Tsai-Wu criteria. The second part of the results shows that leakage occurs due to a combination of matrix tensile and compressive, fiber tensile and compressive, and inplane shear failure modes in all three cylinders. Leakage develops after a relatively low amount of fiber damage, at about the same pressure for three material orthotropies, and at approximately the same location.

Hyer, M. W.↗
DOE OSTI2025

Enhanced upconversion and photoconductive nanocomposites of lanthanide-doped nanoparticles functionalized with low-vibrational-energy inorganic ligands

Upconverting nanoparticles (UCNPs) convert near-infrared (IR) light into higher-energy visible light, allowing them to be used in applications such as biological imaging, nano-thermometry, and photodetection. It is well known that the upconversion luminescent efficiency of UCNPs can be enhanced by using a host material with low phonon energies, but the use of low-vibrational-energy inorganic ligands and non-epitaxial shells has been relatively underexplored. Here, we investigate the functionalization of lanthanide-doped NaYF4 UCNPs with low-vibrational-energy Sn2S64- ligands. Raman spectroscopy and elemental mapping are employed to confirm the binding of Sn2S64- ligands to UCNPs. This binding enhances upconversion efficiencies up to a factor of 16, consistent with an increase in the luminescent lifetimes of the lanthanide ions. Annealing Sn2S64--capped UCNPs results in the formation of a nanocomposite comprised of UCNPs embedded within an interconnected matrix of SnS2, enabling each UCNP to be electrically accessible through the semiconducting SnS2 matrix. This facilitates the integration of UCNPs into electronic devices, which we demonstrate through the fabrication of a UCNP-SnS2 photodetector that detects UV and near-IR light. Our findings show the promise of using inorganic capping agents to enhance the properties of UCNPs while facilitating their integration into optoelectronic devices.

Pan, Jia-Ahn↗
NASA NTRS1981

Mathematical specifications of the Onboard Navigation Package (ONPAC) simulator (revision 1)

The mathematical theory of the computational algorithms employed in the onboard navigation package system is described. This system, which simulates an onboard navigation processor, was developed to aid in the design and evaluation of onboard navigation software. The mathematical formulations presented include the factorized UDU(T) form of the extended Kalman filter, the equations of motion of the user satellite, the user clock equations, the observation equations and their partial derivatives, the coodinate transformations, and the matrix decomposition algorithms.

Dunham, J. B.↗
NASA NTRS1982

Total nitrogen content of deep sea basalts

An estimate of the total nitrogen content of the earth's mantle, aimed at furnishing a further constraint for earth atmosphere origin and evolution models, was attempted through thermal neutron activation analysis via N-14(n,p)C-14 for the case of deep sea basalt glasses from the East Pacific Rise, the Mid-Atlantic Rift, and the Juan de Fuca Ridge. The increased nitrogen abundance of matrix material from the same samples as the glasses may be due to the incorporation of chemically-bound nitrogen from sea water, rather than dissolved molecular nitrogen. A discussion is presented of factors affecting observed basalt nitrogen content and its interpretation in terms of mantle nitrogen abundance. A 2 ppm N lower limit is estimated for the mantle.

Norris, T. L.↗
NASA NTRS1982

Fabrication of advanced composites

Fabrication techniques for manufacturing advanced composite structures with continuous and short filaments in desired orientations and consolidation within the plies of the structure are described and analyzed. Attention is given to vacuum bag molding, autoclave molding, matched die consolidation of B/Al, B/epoxy, and graphite/epoxy composites, matched die molding of chopped fiber prepregs, thermal expansion molding, braiding, filament winding, sandwich fabrication, and pultrusions. Step-by-step preparation of resin-matrix composites is detailed, including automatic and semiautomatic lay-ups, and problems of quality control are discussed. The review is intended as an engineering aid for choices between competitive designs, and comprises factors other than technical features alone, such as cost effectiveness, ease of inspection, and economics of maintenance.

Meade, L. E. R.↗
NASA NTRS1987

Deformation of a metal-matrix tensile coupon with a central slot - An experimental study

A metal-matrix specimen was investigated using high-sensitivity moire interferometry. In-plane displacement fields were analyzed at various load levels from 15 to 95 percent of the failure load. Normal and shear strains were determined from displacement gradients. Highly localized plastic slip zones occured in the ductile aluminum matrix tangent to the ends of the slot. Shear strains in the slip zone were an order of magnitude greater than the largest normal strains in the specimen. The shear-strain concentration factor rose dramatically with the onset of plastic slip and continued to rise gradually with load to 95 percent of the failure load. Upon unloading, shear strains in the slip zone remained precariously high.

Post, Daniel↗
NASA NTRS2008

Human Rating Requirements for NASA's Constellation Program

NASA s Constellation Program (CxP) will conduct a series of human space expeditions of increasing scope, starting with missions supporting the International Space Station and expanding to encompass the Moon and Mars. Although human-rating is an integral part of all CxP activities throughout their life cycle, NASA Procedural Requirements document NPR 8705.2B, Human-Rating Requirements (HRR) for Space Flight Systems, defines the additional processes, procedures, and requirements necessary to produce human-rated space systems that protect the safety of crew members and passengers on these NASA missions. In order to be in compliance with 8705.2B the CxP must show appropriate implementation or progression toward the HRR, or justification for an exception. Compliance includes an explanation of how the CxP intends to meet the HRR, analyses to be performed to determine implementation; and a matrix to trace the HRR to CxP requirements. The HRR requires the CxP to establish a human system integration team (HSIT), consisting of astronauts, mission operations personnel, training personnel, ground processing personnel, human factors personnel, and human engineering experts, with clearly defined authority, responsibility, and accountability to lead the human-system integration. For example, per the HRR the HSIT is involved in the evaluation of crew workload, human-in-the-loop usability evaluations, determining associated criteria, and in assessment of how these activities influenced system design. In essence, the HSIT is invaluable in CxP s ability to meet the three fundamental tenets of human rating: the process of designing, evaluating, and assuring that the total system can safely conduct the required human missions; the incorporation of design features and capabilities that accommodate human interaction with the system to enhance overall safety and mission success; and the incorporation of design features and capabilities to enable safe recovery of the crew from hazardous situations.

Berdich, Debbie↗
DOE OSTI2023

Exploiting Kronecker structure in exponential integrators: Fast approximation of the action of φ $-$functions of matrices via quadrature

Here, in this article, we propose an algorithm for approximating the action of φ $-$ functions of matrices against vectors, which is a key operation in exponential time integrators. In particular, we consider matrices with Kronecker sum structure, which arise from problems admitting a tensor product representation. The method is based on quadrature approximations of the integral form of the φ $-$ functions combined with a scaling and modified squaring method. Owing to the Kronecker sum representation, only actions of 1D matrix exponentials are needed at each quadrature node and assembly of the full matrix can be avoided. Additionally, we derive a priori bounds for the quadrature error, which show that, as expected by classical theory, the rate of convergence of our method is supergeometric. Guided by our analysis, we construct a fast and robust method for estimating the optimal scaling factor and number of quadrature nodes that minimizes the total cost for a prescribed error tolerance. We investigate the performance of our algorithm by solving several linear and semilinear time-dependent problems in 2D and 3D. The results show that our method is accurate and orders of magnitude faster than the current state-of-the-art.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2020

Updates to the n+ 63,65 Cu Evaluations in the Resolved Resonance Region [Slides]

This presentation discusses the motivation and background of the n+ 63,65 Cu Evaluations in the Resolved Resonance Region which is to study the interaction of neutrons with copper as it is important in nuclear applications since critical assembly configurations include metallic copper as reflector. In support to the U.S. Department of Energy (DOE) Nuclear Criticality Safety Program (NCSP), measurements and related evaluations of 63,65 Cu isotopes were selected to improve the agreement with the benchmarks and to assess the importance of the angular distribution data for reactor calculations. Previous and current evaluation work is supported by an experimental campaign initiated before 2010, the 63,65 Cu R-matrix analysis generated resonance parameters up to 300 keV. However, due to outstanding issues in the benchmark performance, ENDF/B-VIII.0 library released a truncated set of resonance parameters up to 100 keV. The goal of this work is to generate an updated set of resonance parameters in the 100-300 keV range to improve the benchmark performance of 63,65 Cu isotopes. In conclusion, R-matrix analysis to update 63,65 Cu evaluations was performed to simultaneously improve benchmark performance and extend the RRR to 300 keV. The benchmark calculations suggest the increased capture cross sections are beneficial, however, further investigation of the measured capture data is needed to understand the large normalization scaling factor needed to improve the reactivity. Also, the copper-reflected benchmarks indicate the need to further investigate angular distributions and extension of RRR to 300 keV is aided well by level statistics considerations. Work to refine the fit of individual resonances is ongoing.

07 ISOTOPE AND RADIATION SOURCES↗
NASA NTRS1990

A study of fracture mechanisms in ATD roller bearing

The purpose was to investigate how microstructures, especially anisotropy, affects internal stresses and the overall mechanical response of bearings. Samples with the stress axis along the aligned carbide direction possessed high modulus values compared to those with their axis perpendicular to the carbide stringers. The difference in the modulus was found to be more than a factor of two. A series of experiments was conducted on rolled samples to further investigate this effect; the two sets of results were consistent with each other. The degree of anisotropy of the microstructure in terms of the carbide and matrix orientations was determined using x-ray diffraction. The stress state determination was conducted using neutron diffraction. It was found that there was little variation in the distribution of the internal stresses amongst different samples, indicating that small changes in the processing and geometrical conditions did not result in significant variations in the internal stress. A nominal tensile hoop stress of 39 ksi was obtained for the inner raceway. Furthermore, during the course of the investigation, it was apparent that there was a need to determine the stress state induced by the shrink fitting process. Therefore, a series of experiments was conducted using strain gages to identify the stress distribution in a shrink fitting process in three different types of geometries. Correlations were obtained to estimate the highest stress values in the outer and inner groove geometry. A finite element program based on the ANSYS system was developed to compute the stress distribution in the inner raceway geometry. This analysis indicates that the highest tensile stress in the system occurs at the ID of the ring with a stress value of over 5 times that of the applied radial stress. Results from all these facets were correlated with one another. It appears that the material does not fail as a result of any one single factor, but results from a combination of the various factors investigated.

Zee, Ralph H.↗
DOE OSTI2021

Hydro-mechanical measurements and x-ray imaging of sheared crystalline rock fractures from EGS Collab experiments 1 & 2

Measuring hydro-mechanical properties of natural fractures is a prerequisite for optimizing hydraulic stimulation design and well placement. We completed experiments to characterize shear on natural fractures in schist, amphibolite, and rhyolite specimens drilled from EGS Collab Project’s field sites at the Sanford Underground Research Facility (SURF) in South Dakota. A triaxial direct shear method and coupled x-ray imaging were used to perform hydroshearing and mechanical shearing at the site’s in-situ stress conditions. This produced simultaneous measurements of fracture and matrix strength, permeability, stress-dependent aperture, dilation, and friction strength. Our results identified that only a subset of the natural fractures was weak enough for hydroshearing. Generally, hydroshearing increases fracture permeability by a factor of 10 or more and the enhancement is retainable over time. However, the shear slip does not always result in permeability enhancement. High content of phyllosilicates was found to associate with exceptionally weak fractures that also exhibited poor or even negative enhancement after stimulation. Combining our measurements with site data, we can predict that most observable fractures at the two EGS Collab sites do not meet the criteria for hydroshearing before tensile opening. In some cases, the visible fractures are low permeability and as strong as the adjacent rock. To induce hydroshearing before tensile opening, injection must target known weak and favorably oriented fractures with confirmed pre-existing permeability.

58 GEOSCIENCES↗
DOE OSTI2025

Resummation for lattice QCD calculation of generalized parton distributions at nonzero skewness

Large-momentum effective theory (LaMET) provides an approach to directly calculate the x-dependence of generalized parton distributions (GPDs) on a Euclidean lattice through power expansion and a perturbative matching. When a parton’s momentum becomes soft, the corresponding logarithms in the matching kernel become non-negligible at higher orders of perturbation theory, which requires a resummation. But the resummation for the off-forward matrix elements at nonzero skewness ξ is difficult due to their multi-scale nature. In this work, we demonstrate that these logarithms are important only in the threshold limit, and derive the threshold factorization formula for the quasi-GPDs in LaMET. We then propose an approach to resum all the large logarithms based on the threshold factorization, which is implemented on a GPD model. We demonstrate that the LaMET prediction is reliable for [−1 + x 0 , −ξ − x 0 ] ∪ [−ξ + x 0 , ξ − x 0 ] ∪ [ξ + x 0 , 1 − x 0 ], where x 0 is a cutoff depending on hard parton momenta. Through our numerical tests with the GPD model, we demonstrate that our method is self-consistent and that the inverse matching does not spread the nonperturbative effects or power corrections to the perturbatively calculable regions.

hadronic spectroscopy↗
DOE OSTI2018

Enhancing the Mechanical Properties of Glassy Nanocomposites by Tuning Polymer Molecular Weight

The addition of nanoparticles to a polymer matrix is a well-known process to improve the mechanical properties of polymers. Many studies of mechanical reinforcement in polymer nanocomposites (PNCs) focus on rubbery matrices; however, much less effort concentrates on the factors controlling the mechanical performance of the technologically important glassy PNCs. This paper presents a study of the effect of the polymer molecular weight (MW) on the overall mechanical properties of glassy PNCs with attractive interaction by using Brillouin light scattering. We found that the mechanical moduli (bulk and shear) have a nonmonotonic dependence on MW that cannot be predicted by simple rule of mixtures. The moduli increase with increasing MW up to 100 kg/mol followed by a drop at higher MW. We demonstrate that the change in the mechanical properties of PNCs can be associated with the properties of the interfacial polymer layer. The latter depend on the interfacial chain packing and stretching, as well as polymer bridging, which vary differently with the MW of the polymer. These competing contributions lead to the observed nonmonotonic variations of the glassy PNC moduli with MW. Our work provides a simple, cost-effective, and efficient way to control the mechanical properties of glassy PNCs by tuning the polymer chain length. Our finding can be beneficial for the rational design of PNCs with desired mechanical performance.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Terahertz Dirac Hyperbolic Metamaterial

Hyperbolic metamaterials (HMMs) are engineered materials with a hyperbolic isofrequency surface, enabling a range of interesting phenomena and applications including negative refraction, enhanced sensing, and subdiffraction imaging, focusing, and waveguiding. Existing HMMs primarily work in the visible and infrared spectral range due to the inherent properties of their constituent materials. Here, we demonstrate a THz-range Dirac HMM using topological insulators as the building blocks. Here, we find that the structure houses up to three high-wavevector volume plasmon polariton (VPP) modes, consistent with transfer matrix modeling and effective medium theory calculations. The VPPs have mode indices greater than 100, significantly larger than observed for VPP modes in HMMs made from metals or doped semiconductors while maintaining comparable quality factors. We attribute these properties to the two-dimensional Dirac nature of the electrons occupying the topological insulator surface states. Because these are van der Waals materials, these structures can be grown at a wafer-scale on a variety of substrates, allowing them to be integrated with existing THz structures and enabling next-generation THz optical devices.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2022

A method to predict texture effect on ion beam channeling analysis of polycrystals and the application to study the mosaic spreading effect in highly oriented pyrolytic graphite

We propose a method to convert the channeling Rutherford backscattering spectrum yield map of a single crystal to a polycrystal through a matrix rotation technique. The rotation matrix is determined by the deviation of the crystal axial direction from the original z axis. The final yield map is created after averaging the rotated yields using the texture function as the weight factor. For highly oriented pyrolytic graphite (HOPG) exhibiting mosaic spread, the method leads to a Gaussian kernel averaging of the map obtained from a single crystal. The yield map of a single crystal is obtained by a simulation of ion trajectories in a potential field described by Moliere screened Coulomb potentials. Yield maps are calculated under various σ values (standard deviations of mosaic spread). The simulated results are compared with experimental results obtained using 1.2 MeV alpha particle. σ is extracted through the best fitting, demonstrating that the method can be used to obtain texture details. The effects of mosaic spread on minimum yield χ min and the half-width at half maximum of angular scans ψ ½ are systematically modeled and compared with previous theoretical equations. The study also shows that previous theoretical equations are valid only at small σ values. The proposed method can be applied to any type of polycrystal and is not limited to HOPG. It provides near-surface mosaic spread and crystallography information with a longitudinal depth resolution of tens of nanometers and is not influenced by grain shapes.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2017

Polycystin-1 interacts with TAZ to stimulate osteoblastogenesis and inhibit adipogenesis

The molecular mechanisms that transduce the osteoblast response to physical forces in the bone microenvironment are poorly understood. In this paper, we used genetic and pharmacological experiments to determine whether the polycystins PC1 and PC2 (encoded by Pkd1 and Pkd2) and the transcriptional coactivator TAZ form a mechanosensing complex in osteoblasts. Compound-heterozygous mice lacking 1 copy of Pkd1 and Taz exhibited additive decrements in bone mass, impaired osteoblast-mediated bone formation, and enhanced bone marrow fat accumulation. Bone marrow stromal cells and osteoblasts derived from these mice showed impaired osteoblastogenesis and enhanced adipogenesis. Increased extracellular matrix stiffness and application of mechanical stretch to multipotent mesenchymal cells stimulated the nuclear translocation of the PC1 C-terminal tail/TAZ (PC1-CTT/TAZ) complex, leading to increased runt-related transcription factor 2–mediated (Runx2-mediated) osteogenic and decreased PPARγ-dependent adipogenic gene expression. Using structure-based virtual screening, we identified a compound predicted to bind to PC2 in the PC1:PC2 C-terminal tail region with helix:helix interaction. This molecule stimulated polycystin- and TAZ-dependent osteoblastogenesis and inhibited adipogenesis. Therefore, we show that polycystins and TAZ integrate at the molecular level to reciprocally regulate osteoblast and adipocyte differentiation, indicating that the polycystins/TAZ complex may be a potential therapeutic target to increase bone mass.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2022

Coreflood Tests to Evaluate Enhanced Oil Recovery Potential of Wettability-Altering Surfactants for Oil-Wet Heterogeneous Carbonate Reservoirs

Summary Oil-wetness and heterogeneity are two main factors that result in low oil recovery (OR) by waterflood in carbonate reservoirs. The injected water is likely to flow through high-permeability regions and bypass the oil in the low-permeability matrix. In this study, systematic coreflood tests were carried out in both “homogeneous” cores and “heterogeneous” cores with a wettability-altering surfactant. The homogeneous coreflood tests were conducted to evaluate surfactant retention, as well as to compare tertiary surfactant flooding with secondary surfactant flooding. The heterogeneous coreflood test was proposed to model bypassing in low-permeability matrix during waterfloods, and dynamic imbibition of surfactant into the low-permeability matrix. Surfactant retention results suggest that retention increases as initial oil saturation decreases. The retention of selected surfactant in the target reservoir cores was measured to be within a range of 0.07–0.12 mg/g-rock, which is economically acceptable. The results of homogeneous coreflood tests showed that both secondary waterflood and secondary surfactant flood can achieve high OR (>50%) from relatively homogeneous oil-wet cores. A shut-in phase after the surfactant injection resulted in a surge in oil production, which suggests that enough time should be given for wettability alteration by surfactants. The results of heterogeneous coreflood tests showed that more oil is bypassed in the tighter matrix by waterflood if the permeability is higher in the flooded layer and this bypassed oil is the target for the wettability-altering surfactant floods. Slow wettability-altering surfactant injection leads to imbibition into bypassed regions. When the oil-wet carbonate reservoirs have large unswept regions after waterflood, wettability-altering surfactants can significantly improve OR if enough time is given for imbibition.

Engineering↗