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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 91 records · Page 5
All sourcesNASA NTRSDOE OSTI
DOE OSTI2017

Direct Evidence of Significant Cation Intermixing in Upconverting Core@Shell Nanocrystals: Toward a New Crystallochemical Model

Core@shell design represents an important class of architectures because of its capability to dramatically increase the absolute upconversion quantum yield (UCQY) of upconverting nanocrystals (UCNCs) but also to tune energy migration pathways. A relatively new trend towards the use of very thick optically inert shells affording significantly higher absolute UCQYs raises the question of the crystallographic and chemical characteristics of such nanocrystals (NCs). In this article, local chemical analyses performed by scanning transmission electron microscopy (STEM) combined with energy dispersive x-ray spectroscopy (EDXS) and x-ray total scattering experiments together with pair distribution function (PDF) analyses were used to probe the local chemical and structural characteristics of hexagonal β-NaGd0.78Yb0.2Er0.02F4@NaYF4 core@shell UCNCs. The investigations lead to a new crystallochemical model to describe core@shell UCNCs that considerably digresses from the commonly accepted epitaxial growth concept with sharp interfaces. The results obtained on ultra-small (4.8 ± 0.5 nm) optically active cores (β-NaGd0.78Yb0.2Er0.02F4) surrounded by an optically inert shell (NaYF4) of tunable thickness (roughly 0, 1, 2, and 3.5 nm) clearly indicate the massive dissolution of the starting seeds and the inter-diffusion of the shell element (such as Y) into the Gd/Yb/Er-containing core giving rise to the formation of a non-homogeneous solid solution characterized by concentration gradients and the lack of sharp interfaces. Independently of the inert shell thickness, core/interface/shell architectures were observed for all synthesized UCNCs. The presented results constitute a significant step towards the comprehensive understanding of the “structure - property” relationship of upconverting core@shell architectures, which is of prime interest not only in the development of more efficient structures but also to provide new physical insights at the nanoscale to better explain upconversion (UC) properties alterations.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
NASA NTRS1999

Global Core Plasma Model

Abstract. The Global Core Plasma Model (GCPM) provides, empirically derived, core plasma density as a function of geomagnetic and solar conditions throughout the inner magnetosphere. It is continuous in value and gradient and is composed of separate models for the ionosphere, the plasmasphere, the plasmapause, the trough, and the polar cap. The relative composition of plasmaspheric H+, He+, and O+ is included in the GCPM. A blunt plasmaspheric bulge and rotation of the bulge with changing geomagnetic conditions is included. The GCPM is an amalgam of density models, intended to serve as a framework for continued improvement as new measurements become available and are used to characterize core plasma density, composition, and temperature.

Gallagher, Dennis L.↗
DOE OSTI2018

Three-cluster dynamics within the ab initio no-core shell model with continuum: How many-body correlations and α clustering shape He 6 [Three-Cluster Dynamics Within The Ab Initio No-Core Shell Model With Continuum: How Many-Body Correlations And Alpha-Clustering Shape 6He]

We realize the treatment of bound and continuum nuclear systems in the proximity of a three-body breakup threshold within the ab initio framework of the no-core shell model with continuum. Many-body eigenstates obtained from the diagonalization of the Hamiltonian within the harmonic-oscillator expansion of the no-core shell model are coupled with continuous microscopic three-cluster states to correctly describe the nuclear wave function both in the interior and asymptotic regions. We discuss the formalism in detail and give algebraic expressions for the case of core + n + n systems. Using similarity-renormalization-group evolved nucleon-nucleon interactions, we analyze the role of 4 He + n + n clustering and many-body correlations in the ground and low-lying continuum states of the Borromean 6 He nucleus, and study the dependence of the energy spectrum on the resolution scale of the interaction. We show that 6 He small binding energy and extended radii compatible with experiment can be obtained simultaneously, without resorting to extrapolations. Here, we also find that a significant portion of the ground-state energy and the narrow width of the first 2 + resonance stem from many-body correlations that can be interpreted as core-excitation effects.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2012

Electric Dipole Transitions Within The Ab initio No-Core Shell Model With Continuum

The no-core shell model with continuum (NCSMC) offers a unified approach to nuclear bound and continuum states based on the coupling of the no-core shell model (NCSM), a bound-state tech nique, with the no-core shell model/resonating group method (NCSM/RGM), a nuclear scattering technique. This new ab initio method leads to convergence properties superior to either NCSM or NCSM/RGM while providing a balanced approach to different classes of states. The NCSMC many nucleon wave function contains: i) a pre-diagonalized A-nucleon NCSM component expanded in the harmonic oscillator basis; ii) a binary-cluster NCSM/RGM component with asymptotic boundary conditions that properly describe weakly bound states, resonances and scattering. Here, we review the main aspects of the NCSM formalism, and provide algebraic expression for the reduced matrix elements of the electric dipole operator, needed to calculate E1 transition probabilities, radiative captures and photodisintegration cross sections.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS2001

The Large-Scale Plasmaspheric Density Trough Associated With the 24 May 2000 Geomagnetic Storm: IMAGE EUV Observations and Global Core Plasma Modeling

The IMAGE EUV imager observed a plasmaspheric density, trough in association with a geomagnetically active period on 24 May 2000. In EUV, this density, trough appears as an Archimedes spiral extending from Earth's shadow to approximately 1900 MLT. We present an analysis of this density trough using simulated EUV images, Observational EUV images are subjected to edge analysis to establish the plasmapause L-shell and the location of the density trough in terms of L-shell, MLT extent, and radial width. The plasmaspheric density distribution is modeled using both static and dynamic models for the plasmasphere. The background plasmasphere is then numerically simulated using the 4-parameter plasmaspheric density model contained within the Global Core Plasma Model (GCPM) and the Dynamic Global Core Plasma Model (DGCPM). Simulated EUV images of the model plasmasphere are produced once an artificial density, depletion, matching the observed MLT extent and width, has been removed. Once the azimuthal extent and width of the trough have been simulated, the depth of the artificial density depletion is iteratively adjusted to produce simulated EUV images that approximate observation. The results of this analysis and discussion of possible origins for this density trough will be presented.

Adrian, M. L.↗
DOE OSTI2014

Leaching behavior of copper from waste printed circuit boards with Brønsted acidic ionic liquid

Highlights: • A Brønsted acidic ILs was used to leach Cu from WPCBs for the first time. • The particle size of WPCBs has significant influence on Cu leaching rate. • Cu leaching rate was higher than 99% under the optimum leaching conditions. • The leaching process can be modeled with shrinking core model, and the E{sub a} was 25.36 kJ/mol. - Abstract: In this work, a Brønsted acidic ionic liquid, 1-butyl-3-methyl-imidazolium hydrogen sulfate ([bmim]HSO{sub 4}), was used to leach copper from waste printed circuit boards (WPCBs, mounted with electronic components) for the first time, and the leaching behavior of copper was discussed in detail. The results showed that after the pre-treatment, the metal distributions were different with the particle size: Cu, Zn and Al increased with the increasing particle size; while Ni, Sn and Pb were in the contrary. And the particle size has significant influence on copper leaching rate. Copper leaching rate was higher than 99%, almost 100%, when 1 g WPCBs powder was leached under the optimum conditions: particle size of 0.1–0.25 mm, 25 mL 80% (v/v) ionic liquid, 10 mL 30% hydrogen peroxide, solid/liquid ratio of 1/25, 70 °C and 2 h. Copper leaching by [bmim]HSO{sub 4} can be modeled with the shrinking core model, controlled by diffusion through a solid product layer, and the kinetic apparent activation energy has been calculated to be 25.36 kJ/mol.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2015

Muscle spindles exhibit core lesions and extensive degeneration of intrafusal fibers in the Ryr1{sup I4895T/wt} mouse model of core myopathy

Muscle spindles from the hind limb muscles of adult Ryr1{sup I4895T/wt} (IT/+) mice exhibit severe structural abnormalities. Up to 85% of the spindles are separated from skeletal muscle fascicles by a thick layer of connective tissue. Many intrafusal fibers exhibit degeneration, with Z-line streaming, compaction and collapse of myofibrillar bundles, mitochondrial clumping, nuclear shrinkage and pyknosis. The lesions resemble cores observed in the extrafusal myofibers of this animal model and of core myopathy patients. Spindle abnormalities precede those in extrafusal fibers, indicating that they are a primary pathological feature in this murine Ryr1-related core myopathy. Muscle spindle involvement, if confirmed for human core myopathy patients, would provide an explanation for an array of devastating clinical features characteristic of these diseases and provide novel insights into the pathology of RYR1-related myopathies. - Highlights: • Muscle spindles exhibit structural abnormalities in a mouse model of core myopathy. • Myofibrillar collapse and mitochondrial clumping is observed in intrafusal fibers. • Myofibrillar degeneration follows a pattern similar to core formation in extrafusal myofibers. • Muscle spindle abnormalities are a part of the pathological phenotype in the mouse model of core myopathy. • Direct involvement of muscle spindles in the pathology of human RYR1-related myopathies is proposed.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2024

Core-edge modeling of gyrokinetic turbulence by coupling the delta-f and total-f models in the XGC code

Whole device gyrokinetic turbulence is modeled using a delta-f model in the core coupled to a total-f model in the edge. This new model is implemented in the gyrokinetic code X-Point Included Gyrokinetic Code (XGC) and works within a single simulation. It employs a canonical Maxwellian background in the core and the usual local Maxwellian in the edge. These different core and edge backgrounds are coupled over an overlap region. A thermal-bath operator is used to keep δf small in the core.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2016

Comparison of HFIR Core Hydraulic Models with Operational Data

The core flow channels of the High Flux Isotope Reactor (HFIR) at Oak Ridge National Laboratory (ORNL) have been modeled with three different computer codes and calculated results have been compared with available plant operational data. The three codes employed are RELAP5-3D, TRACE, and COMSOL. This work was performed to develop consistent boundary conditions for three-dimensional (3-D) computational fluid dynamics (CFD) models of the HFIR core. The variables of interest for the CFD models include: (1) the inlet velocity and (2) outlet pressure for each coolant channel, and (3) the axial pressure difference between narrow and wide adjacent channels. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2022

Preliminary Thermal-hydraulics and Selected Safety Analysis for Holos-Quad Reactor Design

This report presents thermal hydraulics and safety analyses of the 10 MWe Holos-Quad micro-reactor design developed by HolosGen LLC. These analyses were executed under steady-state and station black-out (SBO) transient conditions using the System Analysis Module (SAM), with a focus on ensuring peak fuel temperatures do not exceed the safety thresholds of 1,250°C for steady state normal operating conditions and 1,600°C for transient conditions. For steady-state temperature predictions, a coupled 1D fluid-to-3D solid heat conduction methodology was used. The steady-state simulations included a model of the central core region where power peaking occurs to predict the maximum steady-state fuel temperature, and a coarse-mesh full-core model to provide the initial condition for the consequent transient SBO decay heat removal simulation. The maximum fuel temperature predicted from the central core region simulations under the normal operating condition was 1,222°C, which is below the design limit 1,250°C. To simulate a SBO transient, a full core model was necessary because of the non-axial symmetric core design and heat loss from the outer core structures to the environment. To reduce the required computational costs, a novel scaled subassembly approach was used to model the full core domain. With the full core steady-state temperature distribution provided as the initial condition, the passive decay heat removal of the core was simulated with the scaled subassembly full core model under SBO transient conditions. This analysis showed that the peak fuel temperatures of the Holos-Quad core remained below their steady-state values during the transient, therefore much lower than the safety limit 1,600°C. This is mainly due to the large thermal inertia of the graphite matrix, relatively low power density, and the large surface-to-volume-ratio of the core. The preliminary analyses presented in this report confirm the inherent safety of the Holos-Quad micro-reactor thermal-hydraulics design, as the peak fuel temperatures under both normal and off-normal operational conditions remain within design and safety limits.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2018

Hypernuclear no-core shell model

We extend the No-Core Shell Model (NCSM) methodology to incorporate strangeness degrees of freedom and apply it to single-Λ hypernuclei. After discussing the transformation of the hyperon-nucleon (YN) interaction into Harmonic-Oscillator (HO) basis and the Similarity Renormalization Group transformation applied to it to improve model-space convergence, we introduce two complementary formulations of the NCSM, one that uses relative Jacobi coordinates and symmetry-adapted basis states to fully exploit the symmetries of the hypernuclear Hamiltonian, and one working in a Slater determinant basis of HO states where antisymmetrization and computation of matrix elements is simple and to which an importance-truncation scheme can be applied. For the Jacobi-coordinate formulation, we give an iterative procedure for the construction of the antisymmetric basis for arbitrary particle number and present the formulae used to embed two- and three-baryon interactions into the many-body space. For the Slater-determinant formulation, we report on the conversion of the YN interaction matrix elements from relative to single-particle coordinates, the importance-truncation scheme that tailors the model space to the description of the low-lying spectrum, and the role of the redundant center-of-mass degrees of freedom. We end with a confirmation of both formulations in the four-body system, giving converged ground-state energies for a chiral Hamiltonian, and present a short survey of the A ≤ 7 hyper-helium isotopes.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS2014

A New Global Core Plasma Model of the Plasmasphere

The Global Core Plasma Model (GCPM) is the first empirical model for thermal inner magnetospheric plasma designed to integrate previous models and observations into a continuous in value and gradient representation of typical total densities. New information about the plasmasphere, in particular, make possible significant improvement. The IMAGE Mission Radio Plasma Imager (RPI) has obtained the first observations of total plasma densities along magnetic field lines in the plasmasphere and polar cap. Dynamics Explorer 1 Retarding Ion Mass Spectrometer (RIMS) has provided densities in temperatures in the plasmasphere for 5 ion species. These and other works enable a new more detailed empirical model of thermal in the inner magnetosphere that will be presented. Specifically shown here are the inner-plasmasphere RIMS measurements, radial fits to densities and temperatures for H(+), He(+), He(++), O(+), and O(+) and the error associated with these initial simple fits. Also shown are more subtle dependencies on the f10.7 P-value (see Richards et al. [1994]).

plasmasphere density↗
NASA NTRS2014

A New Global Core Plasma Model of the Plasmasphere

The Global Core Plasma Model (GCPM) is the first empirical model for thermal inner magnetospheric plasma designed to integrate previous models and observations into a continuous in value and gradient representation of typical total densities. New information about the plasmasphere, in particular, makes possible significant improvement. The IMAGE Mission Radio Plasma Imager (RPI) has obtained the first observations of total plasma densities along magnetic field lines in the plasmasphere and polar cap. Dynamics Explorer 1 Retarding Ion Mass Spectrometer (RIMS) has provided densities in temperatures in the plasmasphere for 5 ion species. These and other works enable a new more detailed empirical model of thermal in the inner magnetosphere that will be presented.

Gallagher, D. L.↗
DOE OSTI2019

From Escherichia coli mutant 13 C labeling data to a core kinetic model: A kinetic model parameterization pipeline

Kinetic models of metabolic networks offer the promise of quantitative phenotype prediction. The mechanistic characterization of enzyme catalyzed reactions allows for tracing the effect of perturbations in metabolite concentrations and reaction fluxes in response to genetic and environmental perturbation that are beyond the scope of stoichiometric models. In this study, we develop a two-step computational pipeline for the rapid parameterization of kinetic models of metabolic networks using a curated metabolic model and available 13 C-labeling distributions under multiple genetic and environmental perturbations. The first step involves the elucidation of all intracellular fluxes in a core model of E. coli containing 74 reactions and 61 metabolites using 13 C-Metabolic Flux Analysis ( 13 C-MFA). Here, fluxes corresponding to the mid-exponential growth phase are elucidated for seven single gene deletion mutants from upper glycolysis, pentose phosphate pathway and the Entner-Doudoroff pathway. The computed flux ranges are then used to parameterize the same (i.e., k-ecoli74) core kinetic model for E. coli with 55 substrate-level regulations using the newly developed K-FIT parameterization algorithm. The K-FIT algorithm employs a combination of equation decomposition and iterative solution techniques to evaluate steady-state fluxes in response to genetic perturbations. k-ecoli74 predicted 86% of flux values for strains used during fitting within a single standard deviation of 13 C-MFA estimated values. By performing both tasks using the same network, errors associated with lack of congruity between the two networks are avoided, allowing for seamless integration of data with model building. Product yield predictions and comparison with previously developed kinetic models indicate shifts in flux ranges and the presence or absence of mutant strains delivering flux towards pathways of interest from training data significantly impact predictive capabilities. Using this workflow, the impact of completeness of fluxomic datasets and the importance of specific genetic perturbations on uncertainties in kinetic parameter estimation are evaluated.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2023

Thermal Hydraulic Modeling of an Advanced Nuclear Reactor using open-source MOOSE tools

The aim of this study is to develop model of a small High Temperature Gas cooled Reactor (HTGR) including the balance of plant. This microreactor produces electricity using the thermal power of the nuclear reaction. This work utilizes the MOOSE Multiphysics simulation tools, which are mainly developed at Idaho National Laboratory (INL, Idaho, United States of America). Its thermal-hydraulics and Heat conduction Modules are used to study the fluids behavior in the primary loop and power conversion system and their interactions with the heating structures. More specifically, one verifies that the temperatures, pressures and mass flow rates of the fluids in both loops are consistent and that, at the same time, all the power transfers occur as expected. Moreover, the various mechanical components characteristics (turbine, compressor, pump) are adapted to the reactor operating conditions. This first analysis is conducted using simplified and one-dimensional model for the core. Ultimately, the obtained results are used to build a higher fidelity core model. This step aims to verify that the initial simplified simulation is consistent with the three-dimensional core modeling. In addition, the calculated material temperatures are checked. This study provides a fairly complete model of the thermal hydraulic phenomena for a particular design of High Temperature Gas cooled Reactor.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2012

SPATIALLY RESOLVING SUBSTRUCTURES WITHIN THE MASSIVE ENVELOPE AROUND AN INTERMEDIATE-MASS PROTOSTAR: MMS 6/OMC-3

With the Submillimeter Array, the brightest (sub)millimeter continuum source in the Orion Molecular Cloud-2/3 region, MMS 6, has been observed in the 850 {mu}m continuum emission with approximately 10 times better angular resolution than previous studies ( Almost-Equal-To 0.''3, Almost-Equal-To 120 AU at Orion). The deconvolved size, the mass, and the column density of MMS 6-main are estimated to be 0.''32 Multiplication-Sign 0.''29 (132 AU Multiplication-Sign 120 AU), 0.29 M{sub Sun }, and 2.1 Multiplication-Sign 10{sup 25} cm{sup -2}, respectively. The estimated extremely high mean number density, 1.5 Multiplication-Sign 10{sup 10} cm{sup -3}, suggests that MMS 6-main is likely optically thick at 850 {mu}m. We compare our observational data with three theoretical core models: prestellar core, protostellar core + disk-like structure, and first adiabatic core. These comparisons clearly show that the observational data cannot be modeled as a simple prestellar core with a gas temperature of 20 K. A self-luminous source is necessary to explain the observed flux density in the (sub)millimeter wavelengths. Our recent detection of a very compact and energetic outflow in the CO (3-2) and HCN (4-3) lines supports the presence of a protostar. We suggest that MMS 6 is one of the first cases of an intermediate-mass protostellar core at an extremely young stage. In addition to the MMS 6-main peak, we have also spatially resolved a number of spiky structures and sub-clumps, distributed over the central 1000 AU. The masses of these sub-clumps are estimated to be 0.066-0.073 M{sub Sun }, which are on the order of brown dwarf masses. Higher angular resolution and higher sensitivity observations with ALMA and EVLA will reveal the origin and nature of these structures such as whether they are originated from fragmentations, spiral arms, or inhomogeneity within the disk-like structures/envelope.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2012

K{sup -} and p-bar spectra for AuAu collisions at {radical}s = 200 GeV from STAR, PHENIX, and BRAHMS in comparison to core-corona model predictions

Based on results obtained with event generators we have launched the core-corona model. It describes in a simplified way but quite successfully the centrality dependence of multiplicity and of identified particles observed in heavy-ion reactions at beam energies between {radical}s = 17 and 200 GeV. Also the centrality dependence of the elliptic flow, {upsilon}{sub 2}, for all charged and identified particles could be explained in this model. Here we extend this analysis and study the centrality dependence of single-particle spectra of K{sup -} and p-bar measured by the PHENIX, STAR, and BRAHMS Collaborations. We find that also for these particles the analysis of the spectra in the core-corona model suffers from differences in the data published by the different experimental groups, notably for the pp collisions. As for protons and K{sup +}, for each experience the data agree well with the prediction of the core-corona model but the values of the two necessary parameters depend on the experiments. We show as well that the average momentum as a function of the centrality depends in a very sensitive way on the particle species and may be quite different for particles which have about the same mass. Therefore the idea to interpret this centrality dependence as a consequence of a collective expansion of the system, as done in blast way fits, may be premature.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗