Engineering Papers⌕ Search

SEARCH · Engineering Papers

Results for “Element”

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.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 1,711 records · Page 95

In situ analysis of elemental depth distributions in thin films by combined evaluation of synchrotron x-ray fluorescence and diffraction

In this work we present a method for the in situ analysis of elemental depth distributions in thin films using a combined evaluation of synchrotron x-ray fluorescence and energy-dispersive x-ray diffraction signals. We recorded diffraction and fluorescence signals simultaneously during the reactive annealing of thin films. By means of the observed diffraction signals, the time evolution of phases in the thin films during the annealing processes can be determined. We utilized this phase information to parameterize the depth distributions of the elements in the films. The time-dependent fluorescence signals were then taken to determine the parameters representing the parameterized depth distributions. For this latter step, we numerically calculated the fluorescence intensities for a given set of depth distributions. These calculations handle polychromatic excitation and arbitrary functions of depth distributions and take into account primary and secondary fluorescence. Influences of lateral non-uniformities of the films, as well as the accuracy limits of the method, are investigated. We apply the introduced method to analyze the evolution of elemental depth distributions and to quantify the kinetic parameters during a synthesis process of CuInS{sub 2} thin films via the reactive annealing of Cu-In precursors in a sulfur atmosphere.

36 MATERIALS SCIENCE↗

X-RAY IONIZATION OF HEAVY ELEMENTS APPLIED TO PROTOPLANETARY DISKS

The consequences of the Auger effect on the population of heavy-element ions are analyzed for the case of relatively cool gas irradiated by keV X-rays with intended applications to the accretion disks of young stellar objects. Highly charged ions are rapidly reduced to the doubly charged state in neutral gas, so the aim here is to derive the production rates for these singly and doubly charged ions and to specify their transformation by recombination, charge transfer, and molecular reactions. The theory is illustrated by calculations of the abundances of 11 of the most cosmically abundant heavy elements in a model of a typical T Tauri star disk. The physical properties of the gas are determined with an X-ray irradiated thermal-chemical model, which shows that the disk atmosphere consists of a hot atmosphere overlaying the mainly cool body of the disk. There is a warm transition layer where hydrogen, carbon, and oxygen are transformed from atomic to molecular species and the ionization drops by several orders of magnitude. The doubly charged ions are then largely confined to the hot outer layers of the disk. The nature of the dominant ions below the transition depends sensitively on the poorly constrained abundances of the heavy elements. Observational consequences and connections with the active layers of the magnetorotational instability are briefly discussed.

79 ASTRONOMY AND ASTROPHYSICS↗

NO HEAVY-ELEMENT DISPERSION IN THE GLOBULAR CLUSTER M92

Although there have been recent claims that there is a large dispersion in the abundances of the heavy neutron capture elements in the old Galactic globular cluster M92, we show that the measured dispersion for the absolute abundances of four of the rare earth elements within a sample of 12 luminous red giants in M92 ({<=}0.07 dex) does not exceed the relevant sources of uncertainty. As expected from previous studies, the heavy elements show the signature of the r-process. Their abundance ratios are essentially identical to those of M30, another nearby globular cluster of similar metallicity.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Nanoscale elemental and morphological imaging of nitrogen-fixing cyanobacteria

Nitrogen-fixing cyanobacteria bind atmospheric nitrogen and carbon dioxide using sunlight. This experimental study focused on a laboratory-based model system, Anabaena sp., in nitrogen-depleted culture. When combined nitrogen is scarce, the filamentous prokaryotes reconcile photosynthesis and nitrogen fixation by cellular differentiation into heterocysts. To better understand the influence of micronutrients on cellular function, 2D and 3D synchrotron X-ray fluorescence mappings were acquired from whole biological cells in their frozen-hydrated state at the Bionanoprobe, Advanced Photon Source. To study elemental homeostasis within these chain-like organisms, biologically relevant elements were mapped using X-ray fluorescence spectroscopy and energy-dispersive X-ray microanalysis. Higher levels of cytosolic K + , Ca 2+ , and Fe 2+ were measured in the heterocyst than in adjacent vegetative cells, supporting the notion of elevated micronutrient demand. P-rich clusters, identified as polyphosphate bodies involved in nutrient storage, metal detoxification, and osmotic regulation, were consistently co-localized with K + and occasionally sequestered Mg 2+ , Ca 2+ , Fe 2+ , and Mn 2+ ions. Machine-learning-based k-mean clustering revealed that P/K clusters were associated with either Fe or Ca, with Fe and Ca clusters also occurring individually. In accordance with XRF nanotomography, distinct P/K-containing clusters close to the cellular envelope were surrounded by larger Ca-rich clusters. The transition metal Fe, which is a part of nitrogenase enzyme, was detected as irregularly shaped clusters. The elemental composition and cellular morphology of diazotrophic Anabaena sp. was visualized by multimodal imaging using atomic force microscopy, scanning electron microscopy, and fluorescence microscopy. This paper discusses the first experimental results obtained with a combined in-line optical and X-ray fluorescence microscope at the Bionanoprobe.

Anabaena sp↗

Google Earth Locations of USA and Seafloor Hydrothermal Vents with Associated Rare Earth Element Data

Google Earth .kmz files that contain the locations of geothermal wells and thermal springs in the USA, and seafloor hydrothermal vents that have associated rare earth element data. The file does not contain the actual data, the actual data is available through the GDR website in two tier 3 data sets entitled "Compilation of Rare Earth Element Analyses from US Geothermal Fields and Mid Ocean Ridge (MOR) Hydrothermal Vents" and "Rare earth element content of thermal fluids from Surprise Valley, California"

15 GEOTHERMAL ENERGY↗

Adaptive Algebraic Multigrid for Finite Element Elliptic Equations with Random Coefficients

This thesis presents a two-grid algorithm based on Smoothed Aggregation Spectral Element Agglomeration Algebraic Multigrid (SA-ρAMGe) combined with adaptation. The aim is to build an efficient solver for the linear systems arising from discretization of second-order elliptic partial differential equations (PDEs) with stochastic coefficients. Examples include PDEs that model subsurface flow with random permeability field. During a Markov Chain Monte Carlo (MCMC) simulation process, that draws PDE coefficient samples from a certain distribution, the PDE coefficients change, hence the resulting linear systems to be solved change. At every such step the system (discretized PDE) needs to be solved and the computed solution used to evaluate some functional(s) of interest that then determine if the coefficient sample is acceptable or not. The MCMC process is hence computationally intensive and requires the solvers used to be efficient and fast. This fact that at every step of MCMC the resulting linear system changes, makes an already existing solver built for the old problem perhaps not as efficient for the problem corresponding to the new sampled coefficient. This motivates the main goal of our study, namely, to adapt an already existing solver to handle the problem (with changed coefficient) with the objective to achieve this goal to be faster and more efficient than building a completely new solver from scratch. Our approach utilizes the local element matrices (for the problem with changed coefficients) to build local problems associated with constructed by the method agglomerated elements (a set of subdomains that cover the given computational domain). We solve a generalized eigenproblem for each set in a subspace spanned by the previous local coarse space (used for the old solver) and a vector, component of the error, that the old solver cannot handle. A portion of the spectrum of these local eigen-problems (corresponding to eigenvalues close to zero) form the coarse basis used to define the new two-level method of our interest. We illustrate the performance of this adaptive two-level procedure with a large set of numerical experiments that demonstrate its efficiency over building the solvers from scratch.

97 MATHEMATICS AND COMPUTING↗

Pilot Scale Testing of Lignite Adsorption Capability and the Benefits for the Recovery of Rare Earth Elements from Dilute Leach Solutions

Naturally occurring organic materials containing humic acids show a strong affinity towards rare earth elements (REE) and other critical elements. Leaching experiments on lignite coal waste produced from construction sand production revealed that the contained REEs were associated with the organic matter. Furthermore, adsorption studies revealed that the lignite waste was capable of extracting REEs from a model solution and increased the REE content of the lignite waste by more than 100%. As such, this study aimed to utilize the lignite waste to adsorb REEs from pregnant leach solutions and acid mine drainage sources having low REE concentrations and subsequently leach the lignite material to produce pregnant leach solutions containing relatively high amounts of REEs, which benefits the performance and economic viability of downstream separation and purification processes. An integrated flowsheet was developed based on this concept and tested at a pilot scale. The pregnant leachate solution (PLS) was generated from a heap leach pad containing 2000 tons of Baker seam coarse refuse. The pilot scale circuit was comprised of aluminum precipitation, adsorption using the waste lignite, and rare earth-critical metal (RE-CM) precipitation stages in succession. The results indicated that the aluminum precipitation stage removed over 88% and 99% of the Al and Fe, respectively. The adsorption stage increased the REE content associated with the waste lignite from 457 ppm to 1065 ppm on a whole mass basis. Furthermore, the heavy REE (HREE) content in the feedstock increased by approximately 250%, which raised the percentage of HREE in the REE distribution by 19 absolute percentage points. In addition to the REEs, concentrations of other critical elements such as Mn, Ni, and Zn also improved by 75%, 37%, and 250%, respectively. Bench-scale tests revealed that increasing the solids concentration in the waste lignite and PLS mix from 1% to 20% by weight enhanced the adsorption efficiency from 32.0% to 99.5%, respectively. As such, a new flowsheet was proposed which provides significantly higher REE concentrations in the PLS that can be fed directly to solvent extraction and/or oxalic acid precipitation and, thereby, enhancing process efficiency and economics.

58 GEOSCIENCES↗

A Comparison of Modeling Strategies for Additively Manufactured HFIR Control Elements

The High Flux Isotope Reactor (HFIR) at Oak Ridge National Laboratory is a flux-trap type research reactor that is used for a range of research applications, including neutron scattering experiments, materials irradiation tests, and isotope production. The HFIR core comprises several concentric cylindrical regions; starting from the core centerline and moving radially outwards, these are the flux trap target (FTT) region, the inner and outer fuel elements (IFE and OFE), the inner and outer control elements (ICE and OCE), and the reflector region. The control elements (CEs) are axially zoned into regions of differing absorption strength: the white regions contain only structural aluminum and do not significantly contribute to reactivity control; the gray regions contain tantalum as the primary absorber with a concentration of 38% by volume, and the black regions contain europia (Eu{sub 2}O{sub 3}) as the primary absorber with a concentration of 31% by volume. During operation, the CEs are withdrawn symmetrically in opposite directions from the core to remove the neutron absorbers from the core and maintain criticality. The current approach to fabrication of the HFIR CEs is tedious, outdated, and expensive. In an effort to improve the operational economics of HFIR and to demonstrate the feasibility of advanced manufacturing techniques for production of nuclear reactor components, novel methods for production of neutron-poison bearing aluminum structures have been initiated at ORNL. For this application, the ultrasonic additive manufacturing (UAM) process involves the use of 3D printing technology to construct small cylindrical compacts (0.559 cm in diameter and 0.171 cm in height) of aluminum mixed with neutron-absorbing material. The compacts contain 60% poison (Ta or Eu{sub 2}O{sub 3}) by volume. These compacts are then embedded into an aluminum matrix before formation into the cylindrical shape appropriate for use in HFIR. The CEs produced in this process therefore contain discrete regions of absorbing material, in contrast to the traditional design with homogeneously distributed absorbers. It is therefore of interest to investigate how the HFIR core behavior with discrete CEs differs from the case with homogeneous CEs with respect to some key reactor physics parameters. The primary objective of this study is to compare modeling strategies for the discrete CE design and examine differences in the core physics between the discrete and homogeneous CE designs as predicted by each model. Lessons learned from this investigation may then be used to inform the design process in future endeavors. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Calculation of the evaporation residue cross sections for the synthesis of the superheavy element Z=119 via the {sup 50}Ti+{sup 249}Bk hot fusion reaction

The evaporation residue (ER) cross sections for 3n and 4n evaporation channels in the {sup 50}Ti + {sup 249}Bk reaction leading the formation of {sup 296}119 and {sup 295}119 isotopes are evaluated by means of a modified fusion-by-diffusion model. In the model, the dynamic evolution from dinucleus to mononucleus is taken into account with the two-dimensional coupled Langenvin equations. The calculated maximum ER cross sections in 3n and 4n evaporation channels of the {sup 50}Ti + {sup 249}Bk reaction are 0.17 and 0.57 pb, respectively. The cross section of 0.57 pb is close to the present experimental limit for the registration of the evaporation residual nuclei. Therefore, superheavy element 119 may be the most hopeful new element with Z>118 to be synthesized under somehow improved experimental conditions in the near future.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

The R -process Alliance: Enrichment of r -process Elements in a Simulated Milky Way–like Galaxy

We study the formation of stars with varying amounts of heavy elements synthesized by the rapid neutron-capture process (r-process) based on our detailed cosmological zoom-in simulation of a Milky Way–like galaxy with an N-body/smoothed particle hydrodynamics code, asura. Most stars with no overabundance in r-process elements, as well as the strongly r-process-enhanced (RPE) r-II stars ([Eu/Fe] > +0.7), are formed in dwarf galaxies accreted by the Milky Way within the 6 Gyr after the Big Bang. In contrast, over half of the moderately enhanced r-I stars (+0.3 < [Eu/Fe] ≤ +0.7) are formed in the main in situ disk after 6 Gyr. Our results suggest that the fraction of r-I and r-II stars formed in disrupted dwarf galaxies is larger the higher their [Eu/Fe] is. Accordingly, the most strongly enhanced r-III stars ([Eu/Fe] > +2.0) are formed in accreted components. These results suggest that non-r-process-enhanced stars and r-II stars are mainly formed in low-mass dwarf galaxies that hosted either none or a single neutron star merger, while the r-I stars tend to form in the well-mixed in situ disk. We compare our findings with high-resolution spectroscopic observations of RPE metal-poor stars in the halo and dwarf galaxies, including those collected by the R-Process Alliance. We conclude that observed [Eu/Fe] and [Eu/Mg] ratios can be employed in chemical tagging of the Milky Way’s accretion history.

Chemical enrichment↗

Implementation and verification of a user-defined element (UEL) for coupled thermal-hydraulic-mechanical-chemical (THMC) processes in saturated geological media

Efficient and accurate modeling of the coupled thermal-hydraulic-mechanical-chemical (THMC) processes in various rock formations is indispensable for designing energy geo-structures such as underground repositories for high-level nuclear wastes. Here, this work focuses on developing and verifying an implicit finite element solver for generic coupled THMC problems in geological settings. Starting from the mass, momentum, and energy balance laws, a specialized set of governing equations and a thermoporoelastic constitutive model is derived. This system is then solved by an implicit finite element (FE) scheme. Specifically, the residuals and the Jacobians are scripted in a user-defined element (UEL) subroutine which is then combined with the general-purpose FE software Abaqus Standard to solve initial-boundary value problems. Considering the complexity of the system, the UEL development follows a stepwise manner by first solving the coupled hydraulic-mechanical (HM) and thermal-hydraulic-mechanical (THM) equations before moving on to the full THMC problem. Each implementation step consists of at least one verification test by comparing computed results with closed-form analytical solutions to ensure that the various coupling effects are correctly realized. To demonstrate the robustness of the algorithm and to validate the UEL, a three-dimensional case study is performed with reference to the in-situ heating test of ATLAS at Belgium in 1980s. A hypothetical radionuclide leakage event is then simulated by activating the chemical-concentration degree of freedom and prescribing a constant high concentration at the heater's surface. The model predicts a limited contaminated regime after six years considering both diffusion and advection effects on species transport.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

A least-squares finite element method based on the Helmholtz decomposition for hyperbolic balance laws

In this paper, a least-squares finite element method for scalar nonlinear hyperbolic balance laws is proposed and studied. The approach is based on a formulation that utilizes an appropriate Helmholtz decomposition of the flux vector and is related to the standard notion of a weak solution. This relationship, together with a corresponding connection to negative-norm least-squares, is described in detail. As a consequence, an important numerical conservation theorem is obtained, similar to the famous Lax–Wendroff theorem. The numerical conservation properties of the method in this paper do not fall precisely in the framework introduced by Lax and Wendroff, but they are similar in spirit as they guarantee that when L 2 convergence holds, the resulting approximations approach a weak solution to the hyperbolic problem. The least-squares functional is continuous and coercive in an H -1 -type norm, but not L 2 -coercive. Nevertheless, the L 2 convergence properties of the method are discussed. Convergence can be obtained either by an explicit regularization of the functional, that provides control of the L 2 norm, or by properly choosing the finite element spaces, providing implicit control of the L 2 norm. Numerical results for the inviscid Burgers equation with discontinuous source terms are shown, demonstrating the L 2 convergence of the obtained approximations to the physically admissible solution. The numerical method utilizes a least-squares functional, minimized on finite element spaces, and a Gauss–Newton technique with nested iteration. Finally, we believe that the linear systems encountered with this formulation are amenable to multigrid techniques and combining the method with adaptive mesh refinement would make this approach an efficient tool for solving balance laws (this is the focus of a future study).

97 MATHEMATICS AND COMPUTING↗

Creation of Multi-Principal Element Alloy NiCoCr Nanostructures via Nanosecond Laser-Induced Dewetting

The multi-principal element alloy nanoparticles (MPEA NPs), a new class of nanomaterials, present a highly rewarding opportunity to explore new or vastly different functional properties than the traditional mono/bi/multimetallic nanostructures due to their unique characteristics of atomic-level homogeneous mixing of constituent elements in the nanoconfinements. Here, in this paper, the successful creation of NiCoCr nanoparticles, a well-known MPEA system is reported, using ultrafast nanosecond laser-induced dewetting of alloy thin films. Nanoparticle formation occurs by spontaneously breaking the energetically unstable thin films in a melt state under laser-induced hydrodynamic instability and subsequently accumulating in a droplet shape via surface energy minimization. While NiCoCr alloy shows a stark contrast in physical properties compared to individual metallic constituents, i.e., Ni, Co, and Cr, yet the transient nature of the laser-driven process facilitates a homogeneous distribution of the constituents (Ni, Co, and Cr) in the nanoparticles. Using high-resolution chemical analysis and scanning nanodiffraction, the environmental stability and grain arrangement in the nanoparticles are further investigated. Thermal transport simulations reveal that the ultrashort (≈100 ns) melt-state lifetime of NiCoCr during the dewetting event helps retain the constituent elements in a single-phase solid solution with homogenous distribution and opens the pathway to create the unique MPEA nanoparticles with laser-induced dewetting process.

36 MATERIALS SCIENCE↗

deal.II Implementation of a Weak Galerkin Finite Element Solver for Darcy Flow

This paper presents a weak Galerkin (WG) finite element solver for Darcy flow and its implementation on the deal.II platform. The solver works for quadrilateral and hexahedral meshes in a unified way. It approximates pressure by Q-type degree $k(≥ 0)$ polynomials separately defined in element interiors and on edges/faces. In this work, numerical velocity is obtained in the unmapped Raviart-Thomas space $RT_{[k]}$ via postprocessing based on the novel concepts of discrete weak gradients. The solver is locally mass-conservative and produces continuous normal fluxes. The implementation in deal.II allows polynomial degrees up to 5. Numerical experiments show that our new WG solver performs better than the classical mixed finite element methods.

54 ENVIRONMENTAL SCIENCES↗

Interior energy error estimates for the weak Galerkin finite element method

Consider the Poisson equation in a polytopal domain ΩRC d (d=2,3) as the model problem. In this paper, we study interior energy error estimates for the weak Galerkin finite element approximation to elliptic boundary value problems. In particular, we show that the interior error in the energy norm is bounded by three components: the best local approximation error, the error in negative norms, and the trace error on the element boundaries. This implies that the interior convergence rate can be polluted by solution singularities on the domain boundary, even when the solution is smooth in the interior region. Numerical results are reported to support the theoretical findings. Lastly, to the best of our knowledge, this is the first local energy error analysis that applies to general meshes consisting of polytopal elements and hanging nodes.

97 MATHEMATICS AND COMPUTING↗

Scale-bridging with the extended/generalized finite element method for linear elastodynamics

This paper presents an extended/generalized finite element method for bridging scales in linear elastodynamics in the absence of scale separation. More precisely, the GFEMgl framework is expanded to enable the numerical solution of multiscale problems through the automated construction of specially-tailored shape functions, thereby enabling high-fidelity finite element modeling on simple, fixed finite element meshes. Furthermore, this introduces time-dependencies in the shape functions in that they are subject to continuous adaptation with time. The temporal aspects of the formulation are investigated by considering the Newmark-β time integration scheme, and the efficacy of mass lumping strategies is explored in an explicit time-stepping scheme. This method is demonstrated on representative wave propagation examples as well as a dynamic fracture problem to assess its accuracy and flexibility.

36 MATERIALS SCIENCE↗

Crystal plasticity model of residual stress in additive manufacturing using the element elimination and reactivation method

Selective laser melting is receiving increasing interest as an additive manufacturing technique. Residual stresses induced by the large temperature gradients and inhomogeneous cooling process can favour the generation of cracks. In this work, a crystal plasticity finite element model is developed to simulate the formation of residual stresses and to understand the correlation between plastic deformation, grain orientation and residual stresses in the additive manufacturing process. The temperature profile and grain structure from thermal-fluid flow and grain growth simulations are implemented into the crystal plasticity model. An element elimination and reactivation method is proposed to model the melting and solidification and to reinitialize state variables, such as the plastic deformation, in the reactivated elements. The accuracy of this method is judged against previous method based on the stiffness degradation of liquid regions by comparing the plastic deformation as a function of time induced by thermal stresses. The method is used to investigate residual stresses parallel and perpendicular to the laser scan direction, and the correlation with the maximum Schmid factor of the grains along those directions. The magnitude of the residual stress can be predicted as a function of the depth, grain orientation and position with respect to the molten pool. The simulation results are directly comparable to X-ray diffraction experiments and stress–strain curves.

316 stainless steel↗

Results of Tests of VVER-1000 Fuel Elements with High Fuel Burnup in the MIR Reactor for LOC Incident Conditions

The main results of tests performed on VVER-1000 fuel elements with high burnup of fuel in a channel of the MIR channel reactor for LOC accident conditions are examined. The experimental setup contains one fuel element, which is arranged along the central axis. The aim of the tests is to determine the parameters of cladding depressurization. In the experiment, questions concerning fragmentation, axial displacement, and possible escape of fuel to outside the cladding were studied and the properties of the cladding material and fuel, which were subjected to the extreme parameters, were determined. The main parameters and the results of two experiments are presented. The conditions under which fuel-element depressurization occurred are determined.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗