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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 1,423 records · Page 79
All sourcesNASA NTRSDOE OSTI
NASA NTRS1990

Inelastic transient dynamic analysis of three-dimensional problems by BEM

A general direct boundary element formulation and its numerical implementation for solving transient dynamic problems of three-dimensional isotropic homogeneous or piecewise homogeneous solids involving material nonlinearities are presented. The algorithm produces accurate results for static nonlinear problems by using large time steps. When a large value of yield stress is selected, the incremental inelastic transient algorithm produces results identical to those obtained by elastodynamic analysis.

Ahmad, S.↗
NASA NTRS1994

Quasi-stereoscopic imaging of the solar X-ray corona

The first published three-dimensional images of the solar X-ray corona obtained by means of solar rotational parallax, are presented in stereographic form. Image pairs approximately 12 hours apart during times of stable coronal conditions were selected from the digitized images obtained with the Skylab X-ray Spectrographic Telescope. The image resolution limit is approximately 10 arc sec. Many coronal structures not visible in the separate images are clearly observed when the image pairs are viewed stereoscopically. This method gives a preview of the potential resources for solar research and forecasting of solar-geomagnetic interactions that could be provided by stereoscopic observations of the Sun using a small group of spacecraft. The method is also applicable to other X-ray, ultraviolet, or other wavebands in which the corona has extended, transparent structure.

Batchelor, David↗
NASA NTRS1995

Imaging Inhomogeneities From Dry-Coupled Ultrasonic Scans

Method of imaging spatial distribution of selected physical properties and microstructure of specimen of material based on dry-coupled contact ultrasonic pulse/echo scanning. Ultrasonic transducer scanned across top surface of specimen. At each of many positions on two-dimensional grid on top surface, ultrasonic pulse/echo measurements taken and processed. Offers rapid, nondestructive alternative to destructive metallographic sectioning to obtain picture of inhomogeneity of specimen.

Roth, Don J.↗
DOE OSTI2017

Two-Dimensional Neutronic and Fuel Cycle Analysis of the LEU-Fueled Transatomic Power Molten Salt Reactor

A recent Third Way report detailing $1.3 billion in private investment in advanced reactor technology includes several liquid-fueled molten salt reactor (MSR) concepts. Interest in these MSR concepts is driven by the enhanced safety, economic, and promising fuel cycle benefits of these advanced reactor concepts. The US Department of Energy (DOE) Office of Nuclear Energy established the Gateway for Accelerated Innovation in Nuclear (GAIN) to provide private companies pursuing innovative nuclear energy technologies with access to the technical support necessary to move toward commercialization. GAIN activities in 2016 included competitive selection of projects for vouchers to fund applicant-specific work at national laboratories. One of these GAIN small business voucher awards was to Transatomic Power Corporation (TAP) to work with Oak Ridge National Laboratory (ORNL) to perform neutronic and fuel cycle analysis and design of TAP's innovative MSR concept. The initial phase of this project is to perform two-dimensional (2D) analysis with ORNL-developed tools to verify TAP-calculated metrics and to develop an understanding of the effects of fuel feed and isotopic removal rates to prepare for the more complex three-dimensional (3D) analysis in coming phases. Design information was based on the TAP white papers wherever possible. This summary discusses the results of this initial phase of the collaboration between ORNL and TAP.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2011

Quantum computation with moving quantum dots generated by surface acoustic waves

Motivated by recent experimental observations [M. Kataoka et al., Phys. Rev. Lett. 102, 156801 (2009)], we propose here a theoretical approach to implement quantum computation with bound states of electrons in moving quantum dots generated by the driving of surface acoustic waves. Differing from static quantum dots defined by a series of static electrodes above the two-dimensional electron gas (2DEG), here a single electron is captured from a 2DEG reservoir by a surface acoustic wave and then trapped in a moving quantum dot (MQD) transported across a quasi-one-dimensional channel, wherein all the electrons have been excluded by the actions of the surface gates. The flying qubit introduced here is encoded by the two lowest levels of the electron in the MQD, and the Rabi oscillation between these two levels could be implemented by applying finely selected microwave pulses to the surface gates. By using the Coulomb interaction between the electrons in different MQDs, we show that a desirable two-qubit operation, i.e., iswap gate, could be realized. Readouts of the present flying qubits are also feasible with the current single-electron detected technique.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2023

Archeological wood conservation with selected organosilicon compounds studied by XFM and nanoindentation

Waterlogged wood conservation is a complex and challenging task. Detailed knowledge about the interactions between the applied chemicals and wood is necessary to ensure the effective and safe conservation of wooden artifacts. The present research aims to determine the mechanism of dimensional stabilization of archeological wood by organosilicon compounds using the combination of synchrotron-based X-ray fluorescence microscopy (XFM) and nanoindentation. Archeological oak wood was treated with methyltrimethoxysilane, (3-mercaptopropyl)trimethoxysilane, or 1,3-bis-[(diethylamino)-3-(propoxy)propan-2-ol]-1,1,3,3-tetramethyldisiloxane, which in previous studies were found to be more effective than other organosilicons in stabilizing wood dimensions. The XFM and nanoindentation results showed that all three organosilicons infiltrated wood cell walls and enhanced their mechanical properties. The XFM also showed that part of the chemicals filled some void spaces like cell lumina. Based on the results obtained here and in our previous research, it is determined that the mechanism of archeological wood dimensional stabilization by organosilicon treatment is complex and likely involves both filling cell lumina and infiltration into cell walls where organosilicons interact with wood polymers.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2014

Hot-carrier solar cells using low-dimensional quantum structures

We propose a high-conversion-efficiency solar cell (SC) utilizing the hot carrier (HC) population in an intermediate-band (IB) of a quantum dot superlattice (QDSL) structure. The bandgap of the host semiconductor in this device plays an important role as an energy-selective barrier for HCs in the QDSLs. According to theoretical calculation using the detailed balance model with an air mass 1.5 spectrum, the optimum IB energy is determined by a trade-off relation between the number of HCs with energy exceeding the conduction-band edge and the number of photons absorbed by the valence band−IB transition. Utilizing experimental data of HC temperature in InAs/GaAs QDSLs, the maximum conversion efficiency under maximum concentration (45 900 suns) has been demonstrated to increase by 12.6% as compared with that for a single-junction GaAs SC.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

On the Structure of the AGN Torus through the Fraction of Optically Selected Type 1 AGNs

The ratio in number between unobscured (type 1) and obscured (type 2) active galactic nuclei (AGNs) is often used to explore the structure of the torus in the unified scheme for AGNs. Oh et al. (2015) investigated the type 1 AGN fraction on two-dimensional space in terms of black hole mass (M{sub BH}) and bolometric luminosity (L{sub bol}) and found that the fraction changes depending on both M{sub BH} and L{sub bol}, forming a ridge-shaped distribution. In this study, based on the up-to-date type 1 AGN catalog of Oh et al. (2015), we examine how the trend of the type 1 AGN fraction in the M{sub BH}–L{sub bol} plane is affected by the different methods used to derive M{sub BH} and L{sub bol}, and suggest an analytic model to explain the observations. We use galaxies from the Sloan Digital Sky Survey Data Release 7 in the redshift range 0.01⩽z⩽0.2. In estimating L{sub bol}, we employ two different methods using [O III] and/or [O I] emission lines, and find that the L{sub bol} values obtained from the two methods agree well. We consider the M{sub BH}--σ{sub ∗} relation, the M{sub BH}–L {sub bulge} relation, and the single-epoch Hα-based M{sub BH} estimate in calculating M{sub BH}. We find that the trends of the type 1 AGN fraction with respect to M{sub BH} and L{sub bol} are similar for the different methods of deriving L{sub bol} but different when using different methods to derive M{sub BH}. We present a model based on the clumpy-torus scheme that reproduces the ridge-shaped distribution of the fraction parallel to the iso-Eddington ratio lines.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2017

Simulation Exploration through Immersive Parallel Planes

We present a visualization-driven simulation system that tightly couples systems dynamics simulations with an immersive virtual environment to allow analysts to rapidly develop and test hypotheses in a high-dimensional parameter space. To accomplish this, we generalize the two-dimensional parallel-coordinates statistical graphic as an immersive 'parallel-planes' visualization for multivariate time series emitted by simulations running in parallel with the visualization. In contrast to traditional parallel coordinate's mapping the multivariate dimensions onto coordinate axes represented by a series of parallel lines, we map pairs of the multivariate dimensions onto a series of parallel rectangles. As in the case of parallel coordinates, each individual observation in the dataset is mapped to a polyline whose vertices coincide with its coordinate values. Regions of the rectangles can be 'brushed' to highlight and select observations of interest: a 'slider' control allows the user to filter the observations by their time coordinate. In an immersive virtual environment, users interact with the parallel planes using a joystick that can select regions on the planes, manipulate selection, and filter time. The brushing and selection actions are used to both explore existing data as well as to launch additional simulations corresponding to the visually selected portions of the input parameter space. As soon as the new simulations complete, their resulting observations are displayed in the virtual environment. This tight feedback loop between simulation and immersive analytics accelerates users' realization of insights about the simulation and its output.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2016

Role of belly board device in the age of intensity modulated radiotherapy for pelvic irradiation

Small bowel dose often represents a limiting factor for radiation treatment of pelvic malignancies. To reduce small bowel toxicity, a belly board device (BBD) with a prone position is often recommended. Intensity modulated radiotherapy (IMRT) could reduce dose to small bowel based on the desired dose-volume constraints. We investigated the efficacy of BBD in conjunction with IMRT. A total of 11 consecutive patients with the diagnosis of rectal cancer, who were candidates for definitive therapy, were selected. Patients were immobilized with BBD in prone position for simulation and treatment. Supine position computed tomography (CT) data were either acquired at the same time or during a diagnostic scan, and if existed was used. Target volumes (TV) as well as organs at risk (OAR) were delineated in both studies. Three-dimensional conformal treatment (3DCRT) and IMRT plans were made for both scans. Thus for each patient, 4 plans were generated. Statistical analysis was conducted for maximum, minimum, and mean dose to each structure. When comparing the normalized mean Gross TV dose for the different plans, there was no statistical difference found between the planning types. There was a significant difference in small bowel sparing when using prone position on BBD comparing 3DCRT and IMRT plans, favoring IMRT with a 29.6% reduction in dose (p = 0.007). There was also a statistically significant difference in small bowel sparing when comparing supine position IMRT to prone-BBD IMRT favoring prone-BBD IMRT with a reduction of 30.3% (p = 0.002). For rectal cancer when small bowel could be a limiting factor, prone position using BBD along with IMRT provides the best sparing. We conclude that whenever a dose escalation in rectal cancer is desired where small bowel could be limiting factor, IMRT in conjunction with BBD should be selected.

61 RADIATION PROTECTION AND DOSIMETRY↗
DOE OSTI2015

Hydrothermal synthesis and characterization of a two-dimensional piperazinium cobalt–zinc phosphate via a metastable one-dimensional phase

A two-dimensional piperazinium cobalt–zinc phosphate, formulated as (C{sub 4}N{sub 2}H{sub 12}){sub 1.5}(Co{sub 0.6}Zn{sub 0.4}){sub 2}(HPO{sub 4}){sub 2}(PO{sub 4})·H{sub 2}O (2D), was synthesized under hydrothermal conditions. The crystal structure was determined using single-crystal X-ray diffraction data (monoclinic P2{sub 1}/c, a=8.1165(3) Å, b=26.2301(10) Å, c=8.3595(4) Å, and β=110.930(5)°) and the hydrogen atom positions were optimized by DFT calculations. A single-crystal corresponding to one-dimensional metastable phase, (C{sub 4}N{sub 2}H{sub 12})Co{sub 0.3}Zn{sub 0.7}(HPO{sub 4}){sub 2}·H{sub 2}O (1D), was also isolated and the crystal structure was determined (monoclinic P2{sub 1}/c, a=8.9120(6) Å, b=14.0290(1) Å, c=12.2494(5) Å, and β=130.884(6)°). The bulk was characterized by chemical (C–H–N) analysis, powder X-ray diffraction (PXRD), powder X-ray thermodiffractometry (HT-XRD), transmission electron microscopy (STEM(DF)-EDX and EFTEM), and thermal analysis (TG/SDTA-MS), including activation energy data of its thermal decomposition. The magnetic susceptibility and magnetization measurements show no magnetic ordering down to 4 K. - Graphical abstract: Hydrothermal synthesis and structural characterization of a two-dimensional piperazinium cobalt–zinc phosphate, (C{sub 4}N{sub 2}H{sub 12}){sub 1.5}(Co{sub 0.6}Zn{sub 0.4}){sub 2}(HPO{sub 4}){sub 2}(PO{sub 4})·H{sub 2}O (2D), have been reported. The crystal structure of a one-dimensional piperazinium cobalt–zinc phosphate, (C{sub 4}N{sub 2}H{sub 12})Co{sub 0.3}Zn{sub 0.7}(HPO{sub 4}){sub 2}·H{sub 2}O (1D) a metastable phase during the hydrothermal synthesis, was also determined. The thermal behavior of 2D compound is strongly dependent on the selected heating rate and the magnetic susceptibility and magnetization measurements show no magnetic ordering down to 4 K. - Highlights: • A 2D piperazinium cobalt–zinc phosphate has been synthesized and characterized. • Crystal structure of 1D metastable phase was also determined. • Thermal behavior of 2D compound is strongly dependent on the selected heating rate. • Magnetic measurements show no magnetic ordering down to 4 K.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Two-Dimensional Copper Iodide-Based Inorganic–Organic Hybrid Semiconductors: Synthesis, Structures, and Optical and Transport Properties

A group of copper iodide-based hybrid semiconductors with the general formula of 2D-CuI(L) 0.5 (L = organic ligands) are synthesized and structurally characterized. All compounds are two-dimensional (2D) networks made of one-dimensional (1D) copper iodide staircase chains that are interconnected by bidentate nitrogen-containing ligands. Results from optical absorption and emission experiments and density functional theory (DFT) calculations reveal that their photoluminescence (PL) can be systematically tuned by adjusting the lowest unoccupied molecular orbital (LUMO) energies of the organic ligands. Charge carrier transport measurements were carried out for the first time on single crystals of selected 2D-CuI(L) 0.5 structures, and the results show that they possess p-type conductivity with a Hall mobility of ~1 cm 2 V -1 s -1 for 2D-CuI(pm) 0.5 and 0.13 cm 2 V -1 s -1 for 2D-CuI(pz) 0.5 , respectively. These values are comparable to or higher than the mobilities of typical highly luminescent organic semiconductors. Finally, this work suggests that robust, high-dimensional copper iodide hybrid semiconductors are promising candidates to be considered as a new type of emissive layer for light-emitting diode (LED) devices.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Assessment of Controlling Processes for Field-Scale Uranium Reactive Transport under Highly Transient Flow Conditions

This paper presents the results of a comprehensive model-based analysis of a uranium tracer test conducted at the U.S Department of Energy Hanford 300 Area (300A) IFRC site. A three-dimensional multi-component reactive transport model was employed to assess the key factors and processes that control the field-scale uranium reactive transport. Taking into consideration of relevant physical and chemical processes, the selected conceptual/numerical model replicates the spatial and temporal variations of the observed U(VI) concentrations reasonably well in spite of the highly complex field conditions. A sensitivity analysis was performed to interrogate the relative importance of various processes and factors for reactive transport of U(VI) at the field-scale. The results indicate that multi-rate U(VI) sorption/desorption, U(VI) surface complexation reactions, and initial U(VI) concentrations were the most important processes and factors controlling U(VI) migration. On the other hand, cation exchange reactions, the choice of the surface complexation model, and dual-domain mass transfer processes, which were previously identified to be important in laboratory experiments, played less important roles under the field-scale experimental condition at the 300A site. However, the model simulations also revealed that the groundwater chemistry was relatively stable during the uranium tracer experiment and therefore presumably not dynamic enough to appropriately assess the effects of ion exchange reaction and the choice of surface complexation models on U(VI) sorption and desorption. Furthermore, it also showed that the field experimental duration (16 days) was not sufficiently long to precisely assess the role of a majority of the sorption sites that were accessed by slow kinetic processes within the dual domain model. The sensitivity analysis revealed the crucial role of the intraborehole flow that occurred within the long-screened monitoring wells and thus significantly affected both field-scale measurements and simulated U(VI) concentrations as a combined effect of aquifer heterogeneity and highly dynamic flow conditions. Overall, this study, which provides one of the few detailed and highly data-constrained uranium transport simulations, highlights the difference in controlling processes between laboratory and field scale that prevent a simple direct upscaling of laboratory-scale models.

07 ISOTOPE AND RADIATION SOURCES↗
DOE OSTI2020

Entanglement and the double copy

We construct entangled states of gluons that scatter exactly as if they were gravitons. Operationally, these objects implement the double copy at the level of the wave function. Our analysis begins with a general ansatz for a wave function characterizing gluons in two copies of SU(N ) gauge theory. Given relatively minimal assumptions following from permutation invariance and dimensional analysis, the three- and four-particle wave functions generate scattering amplitudes that automatically coincide exactly with gravity, modulo normalization. For five-particle scattering the match is not automatic but imposing certain known selection rules on the amplitude is sufficient to uniquely reproduce gravity. The resulting amplitudes exhibit a color-dressed and permutation-invariant form of the usual double copy relations. We compute the entanglement entropy between the two gauge theory copies and learn that these states are maximally-entangled at large N. Moreover, this approach extends immediately to effective field theories, where Born-Infeld photons and Galileons can be similarly recast as entangled gluons and pions.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2017

Convection Effects During Bulk Transparent Alloy Solidification in DECLIC-DSI and Phase-Field Simulations in Diffusive Conditions

In order to study the dynamical formation and evolution of cellular and dendritic arrays under diffusive growth conditions, three-dimensional (3D) directional solidification experiments were conducted in microgravity on a model transparent alloy onboard the International Space Station using the Directional Solidification Insert in the DEvice for the study of Critical LIquids and Crystallization. Selected experiments were repeated on Earth under gravity-driven fluid flow to evidence convection effects. Both radial and axial macrosegregation resulting from convection are observed in ground experiments, and primary spacings measured on Earth and microgravity experiments are noticeably different. The microgravity experiments provide unique benchmark data for numerical simulations of spatially extended pattern formation under diffusive growth conditions. The results of 3D phase-field simulations highlight the importance of accurately modeling thermal conditions that strongly influence the front recoil of the interface and the selection of the primary spacing. The modeling predictions are in good quantitative agreements with the microgravity experiments.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Integrated inertial fusion energy chamber dynamics and response

Here, this paper presents results of three-dimensional hydrodynamics simulations of the flow inside a model inertial fusion energy (IFE) fusion chamber. Turbulence modeling employing the large-eddy simulation approach is used to estimate the gas dynamics, state, and mixing after a sufficiently large number of target ignitions. The rich radiation-flow physics that takes place immediately after the lasers hit the hohlraum is modeled separately using a high-fidelity one-dimensional model, which provides reference conditions for the complex geometry three-dimensional turbulence simulations. The IFE geometry includes optical ports and recirculation openings as well as a duct to evacuate the debris produced after each energy deposition (as a model of a laser shot). Furthermore, a selected set of sensitivity studies are conducted to estimate the effect of uncertainty in radiative properties of the Xenon gas at the prevalent conditions in the chamber. The results provide guidance regarding the turbulence conditions in the chamber, which seem to have entered a decay state immediately before a new shot takes place. Computational estimates of the density variability within the chamber as well as pressure history at the approximate location of the laser optical ports is presented among other turbulence statistics.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2015

Hippocampal phosphoproteomics of F344 rats exposed to 1-bromopropane

1-Bromopropane (1-BP) is neurotoxic in both experimental animals and human. To identify phosphorylated modification on the unrecognized post-translational modifications of proteins and investigate their role in 1-BP-induced neurotoxicity, changes in hippocampal phosphoprotein expression levels were analyzed quantitatively in male F344 rats exposed to 1-BP inhalation at 0, 400, or 1000 ppm for 8 h/day for 1 or 4 weeks. Hippocampal protein extracts were analyzed qualitatively and quantitatively by Pro-Q Diamond gel staining and SYPRO Ruby staining coupled with two-dimensional difference in gel electrophoresis (2D-DIGE), respectively, as well as by matrix-assisted laser-desorption ionization time-of-flight (MALDI-TOF) mass spectrometry (MS) to identify phosphoproteins. Changes in selected proteins were further confirmed by Manganese II (Mn{sup 2+})-Phos-tag SDS-polyacrylamide gel electrophoresis (SDS-PAGE). Bax and cytochrome c protein levels were determined by western blotting. Pro-Q Diamond gel staining combined with 2D-DIGE identified 26 phosphoprotein spots (p < 0.05), and MALDI-TOF/MS identified 18 up-regulated proteins and 8 down-regulated proteins. These proteins are involved in the biological process of response to stimuli, metabolic processes, and apoptosis signaling. Changes in the expression of phosphorylated 14-3-3 θ were further confirmed by Mn{sup 2+}-Phos-tag SDS-PAGE. Western blotting showed overexpression of Bax protein in the mitochondria with down-regulation in the cytoplasm, whereas cytochrome c expression was high in the cytoplasm but low in the mitochondria after 1-BP exposure. Our results suggest that the pathogenesis of 1-BP-induced hippocampal damage involves inhibition of antiapoptosis process. Phosphoproteins identified in this study can potentially serve as biomarkers for 1-BP-induced neurotoxicity. - Highlights: • 1-BP modified hippocampal phosphoproteome in rat and 23 altered proteins were identified. • 1-BP changed phosphorylation of GRP78, 14-3-3 θ, PSMC3, ST13, PURA, GNB2, APOE, PEA15 and ATP5H. • 1-BP-induced hippocampal damage involves inhibition of antiapoptosis process.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2020

Particle-Scale Reduction Analysis of CuFeMnO 4 with Hydrogen for Chemical Looping Combustion

In this work CuFeMnO 4 (copper iron manganese oxide) oxygen carrier was characterized using DSC/TGA, in-situ XRD, and SEM-EDS to gain a clear elucidation of the chemical looping combustion (CLC) reactions with H2 which is a component of synthesis gas. A reaction model which best described the experimental TGA reaction data was selected from the analysis. Intrinsic rate of reaction parameters obtained from the study could be used for designing a reactor for scale-up. A model with combined contributions from nucleation and growth model and dimensional phase boundary model was found to exhibit the best correlation with the experimental data. The analysis provided validation of intrinsic reaction rates and other rate parameters.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗