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At least 487 records · Page 27

Modified Steklov Functions and Numerical Differentiation Formulas

We consider an approximation method based on Steklov functions of the first and second order. We obtain estimates for the norms in the space C of continuous periodic functions and clarify how they connect with numerical differentiation formulas.

97 MATHEMATICS AND COMPUTING↗

Exact Green's function method of solar force-free magnetic-field computations with constant alpha. I - Theory and basic test cases

Exact closed-form solutions to the solar force-free magnetic-field boundary-value problem are obtained for constant alpha in Cartesian geometry by a Green's function approach. The uniqueness of the physical problem is discussed. Application of the exact results to practical solar magnetic-field calculations is free of series truncation errors and is at least as economical as the approximate methods currently in use. Results of some test cases are presented.

Chiu, Y. T.↗

A low tritium hydride bed inventory estimation technique

Low tritium hydride beds were developed and deployed into tritium service in Savannah River Site. Process beds to be used for low concentration tritium gas were not fitted with instrumentation to perform the steady-state, flowing gas calorimetric inventory measurement method. Low tritium beds contain less than the detection limit of the IBA (In-Bed Accountability) technique used for tritium inventory. This paper describes two techniques for estimating tritium content and uncertainty for low tritium content beds to be used in the facility's physical inventory (PI). PI are performed periodically to assess the quantity of nuclear material used in a facility. The first approach (Mid-point approximation method - MPA) assumes the bed is half-full and uses a gas composition measurement to estimate the tritium inventory and uncertainty. The second approach utilizes the bed's hydride material pressure-composition-temperature (PCT) properties and a gas composition measurement to reduce the uncertainty in the calculated bed inventory.

07 ISOTOPE AND RADIATION SOURCES↗

Effect of Grain Boundaries on the Performance of Thin-Film-Based Polycrystalline Silicon Solar Cells: A Numerical Modeling

Solar cells/photovoltaic, a renewable energy source, is appraised to be the most effective alternative to the conventional electrical energy generator. A cost-effective alternative of crystalline wafer-based solar cell is thin-film polycrystalline-based solar cell. This paper reports the numerical analysis of dependency of the solar cell parameters (i.e., efficiency, fill factor, open-circuit voltage and short-circuit current density) on grain size for thin-film-based polycrystalline silicon (Si) solar cells. A minority carrier lifetime model is proposed to do a correlation between the grains, grain boundaries and lifetime for thin-film-based polycrystalline Si solar cells in MATLAB environment. As observed, the increment in the grain size diameter results in increase in minority carrier lifetime in polycrystalline Si thin film. A non-equivalent series resistance double-diode model is used to find the dark as well as light (AM1.5) current–voltage (I-V) characteristics for thin-film-based polycrystalline Si solar cells. To optimize the effectiveness of the proposed model, a successive approximation method is used and the corresponding fitting parameters are obtained. The model is validated with the experimentally obtained results reported elsewhere. The experimentally reported solar cell parameters can be found using the proposed model described here.

36 MATERIALS SCIENCE↗

Progress in integrated-circuit horn antennas for receiver applications. Part 1: Antenna design

The purpose of this work is to present a systematic method for the design of multimode quasi-integrated horn antennas. The design methodology is based on the Gaussian beam approach and the structures are optimized for achieving maximum fundamental Gaussian coupling efficiency. For this purpose, a hybrid technique is employed in which the integrated part of the antennas is treated using full-wave analysis, whereas the machined part is treated using an approximate method. This results in a simple and efficient design process. The developed design procedure has been applied for the design of a 20, a 23, and a 25 dB quasi-integrated horn antennas, all with a Gaussian coupling efficiency exceeding 97 percent. The designed antennas have been tested and characterized using both full-wave analysis and 90 GHz/370 GHz measurements.

Eleftheriades, George V.↗

An investigation of dynamic-analysis methods for variable-geometry structures

Selected space structure configurations were reviewed in order to define dynamic analysis problems associated with variable geometry. The dynamics of a beam being constructed from a flexible base and the relocation of the completed beam by rotating the remote manipulator system about the shoulder joint were selected. Equations of motion were formulated in physical coordinates for both of these problems, and FORTRAN programs were developed to generate solutions by numerically integrating the equations. These solutions served as a standard of comparison to gauge the accuracy of approximate solution techniques that were developed and studied. Good control was achieved in both problems. Unstable control system coupling with the system flexibility did not occur. An approximate method was developed for each problem to enable the analyst to investigate variable geometry effects during a short time span using standard fixed geometry programs such as NASTRAN. The average angle and average length techniques are discussed.

Austin, F.↗

The order of three lowest-energy states of the six-electron harmonium at small force constant

The order of low-energy states of six-electron harmonium is uncertain in the case of strong correlation, which is not a desired situation for the model system being considered for future testing of approximate methods of quantum chemistry. The computational study of these states has been carried out at the frequency parameter ω = 0.01, using the variational method with the basis of symmetry-projected, explicitly correlated Gaussian (ECG) lobe functions. It has revealed that the six-electron harmonium at this confinement strength is an octahedral Wigner molecule, whose order of states is different than in the strong confinement regime and does not agree with the earlier predictions. The results obtained for ω = 0.5 and 10 are consistent with the findings based on the Hund’s rules for the s{sup 2}p{sup 4} electron configuration. Substantial part of the computations has been carried out on the graphical processing units and the efficiency of these devices in calculation of the integrals over ECG functions has been compared with traditional processors.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Calculation of Compressible Flows past Aerodynamic Shapes by Use of the Streamline Curvature

A simple approximate method is given for the calculation of isentropic irrotational flows past symmetrical airfoils, including mixed subsonic-supersonic flows. The method is based on the choice of suitable values for the streamline curvature in the flow field and the subsequent integration of the equations of motion. The method yields limiting solutions for potential flow. The effect of circulation is considered. A comparison of derived velocity distributions with existing results that are based on calculation to the third order in the thickness ratio indicated satisfactory agreement. The results are also presented in the form of a set of compressibility correction rules that lie between the Prandtl-Glauert rule and the von Karman-Tsien rule (approximately). The different rules correspond to different values of the local shape parameter square root sign YC sub a, in which Y is the ordinate and C sub a is the curvature at a point on an airfoil. Bodies of revolution, completely supersonic flows, and the significance of the limiting solutions for potential flow are also briefly discussed.

Perl, W↗

The Unsteady Lift of a Finite Wing

Unsteady lift function for wings of finite aspect ratio have been calculated by approximate methods involving corrections of the aerodynamic inertia and of the angle of the infinite wing. The starting lift of the finite wing is found to be only slightly less than that of the infinite wing; whereas the final lift may be considerably less. The calculations indicate that the distribution of lift near the start is similar to the final distribution. Both the indicia and the oscillating lift functions are given. Approximate operational equivalents of the functions have been devised to facilitate the calculation of lift under various conditions of motion.

Jones, Robert T↗

Theoretical analysis of incompressible flow through a radial-inlet centrifugal impeller at various weight flows

A method for the solution of the incompressible nonviscous flow through a centrifugal impeller, including the inlet region, is presented. Several numerical solutions are obtained for four weight flows through an impeller at one operating speed. These solutions are refined in the leading-edge region. The results are presented in a series of figures showing streamlines and relative velocity contours. A comparison is made with the results obtained by using a rapid approximate method of analysis.

Kramer, James J↗

Probabilistic structural analysis: Introductory remarks

The development of probabilistic structural analysis methodology consists of the following program elements: (1) composite load spectra models, (2) computational probabilistic structural analysis methods, and (3) probabilistic constitutive relationships. The development of the probabilistic structural analysis methodology is a joint program of NASA Lewis in-house and sponsored research. The objective of this session is to illustrate recent progress on the application of this methodology to determine the reliability of structural components for rocket propulsion systems. The session contains descriptions of and progress reports on the following specific activities: (1) The NESSUS computer code, (2) approximate methods, (3) advanced methods, (4) composite load spectra applications, (5) probabilistic fracture mechanisms, and (6) probability of failure and risk analysis. Collectively, the progress to date demonstrates that the structural durability of hot engine structural components can be effectively evaluated in a formal probabilistic/reliability framework.

Chamis, Christos C.↗

On random fuzzy fractional partial integro-differential equations under Caputo generalized Hukuhara differentiability

This paper is devoted to the study of the solvability of random fuzzy fractional partial integro-differential equations under Caputo generalized Hukuhara differentiability. The notions of random fuzzy variables and fuzzy stochastic processes are developed for multivariable functions. The existence and uniqueness of two types of integral solutions generated from Darboux problem for nonlinear wave equations are proved using the successive approximations method and Gronwall’s inequality for stochastic processes. The continuous dependence on the data, the boundedness, and the stability with probability one of integral solutions are established to confirm the well posedness of our model. Some computational examples are presented to illustrate the theoretical results.

97 MATHEMATICS AND COMPUTING↗

Numerical computations on one-dimensional inverse scattering problems

An approximate method to determine the index of refraction of a dielectric obstacle is presented. For simplicity one dimensional models of electromagnetic scattering are treated. The governing equations yield a second order boundary value problem, in which the index of refraction appears as a functional parameter. The availability of reflection coefficients yield two additional boundary conditions. The index of refraction by a k-th order spline which can be written as a linear combination of B-splines is approximated. For N distinct reflection coefficients, the resulting N boundary value problems yield a system of N nonlinear equations in N unknowns which are the coefficients of the B-splines.

Dunn, M. H.↗

Numerical computations on one-dimensional inverse scattering problems

An approximate method to determine the index of refraction of a dielectric obstacle is presented. For simplicity one dimensional models of electromagnetic scattering are treated. The governing equations yield a second order boundary value problem, in which the index of refraction appears as a functional parameter. The availability of reflection coefficients yield two additional boundary conditions. The index of refraction by a k-th order spline which can be written as a linear combination of B-splines is approximated. For N distinct reflection coefficients, the resulting N boundary value problems yield a system of N nonlinear equations in N unknowns which are the coefficients of the B-splines.

Dunn, M. H.↗

Fast Learning for Immersive Engagement in Energy Simulations

The fast computation which is critical for immersive engagement with and learning from energy simulations would be furthered by developing a general method for creating rapidly computed simplified versions of NREL's computation-intensive energy simulations. Created using machine learning techniques, these 'reduced form' simulations can provide statistically sound estimates of the results of the full simulations at a fraction of the computational cost with response times - typically less than one minute of wall-clock time - suitable for real-time human-in-the-loop design and analysis. Additionally, uncertainty quantification techniques can document the accuracy of the approximate models and their domain of validity. Approximation methods are applicable to a wide range of computational models, including supply-chain models, electric power grid simulations, and building models. These reduced-form representations cannot replace or re-implement existing simulations, but instead supplement them by enabling rapid scenario design and quality assurance for large sets of simulations. We present an overview of the framework and methods we have implemented for developing these reduced-form representations.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Impact of representative ground motion level on seismic PSA with the boundary between overestimation and underestimation

One commonly used approach in seismic probabilistic safety assessment (PSA) is the discrete method. This method follows the standard PSA framework and can be applied to various models, such as multi-unit models, while reducing computational costs using standard software. However, due to the inability to subdivide intervals infinitely, the discrete method approximates with a finite number of subintervals. In practice, different numbers of subintervals are applied, and the representative ground motion level is selected based on expert judgment. When employing a smaller number of subintervals, it is important to take caution to prevent underestimation. This study analyzes the impact of the representative ground motion level on seismic risk. It confirms that underestimation can occur with a small number of subintervals depending on the representative ground motion level. This study also proposes a method for determining the boundary of underestimation and overestimation. The method is demonstrated through examples, providing a mathematical foundation for selecting appropriate representative ground motion levels. By avoiding underestimation, this research helps prevent the oversight of significant risk contributors and enhances the understanding of seismic risk.

99 - GENERAL AND MISCELLANEOUS↗

A 3D finite element ALE method using an approximate Riemann solution

Arbitrary Lagrangian–Eulerian finite volume methods that solve a multidimensional Riemann-like problem at the cell center in a staggered grid hydrodynamic (SGH) arrangement have been proposed. This research proposes a new 3D finite element arbitrary Lagrangian–Eulerian SGH method that incorporates a multidimensional Riemann-like problem. Here, two different Riemann jump relations are investigated. A new limiting method that greatly improves the accuracy of the SGH method on isentropic flows is investigated. A remap method that improves upon a well-known mesh relaxation and remapping technique in order to ensure total energy conservation during the remap is also presented. Numerical details and test problem results are presented.

97 MATHEMATICS AND COMPUTING↗

Optimization of Random Phase Approximation Calculations for Improved Energies of Molecules, Solids, and Surfaces

We present an optimized random phase approximation method (optRPA26) that significantly improves upon conventional RPA through an optimized choice of reference orbitals and energy components, rather than a modification of the RPA correlation functional itself. The method employs an empirically constructed hybrid functional to generate DFT orbitals to evaluate the RPA correlation energy, which is then scaled by a constant. Comprehensive benchmarks across molecules, bulk solids, and surface systems demonstrate that optRPA26 consistently achieves high accuracy, with mean absolute errors of 0.05 eV for W4-11-RE reaction energies, 0.07 eV for cohesive energies, 0.09 eV for metal oxide formation energies, 0.11–0.12 eV for adsorption of small molecules on metals, and 0.06 eV for adsorption on oxides. In addition, optRPA26 correctly captures phase stability in metal oxides and magnetic metals. The optRPA26 approach can be run using standard RPA implementations, highlighting its potential as a general-purpose reference method that can accurately capture covalent, ionic, metallic, and van der Waals bonding in molecules, solids, and interfaces.

Adsorption↗