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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 1,531 records · Page 85
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

Fractional heat conduction with heat absorption in a sphere under Dirichlet boundary condition

The time-fractional heat conduction equation with the Caputo derivative and with heat absorption term proportional to temperature is considered in a sphere in the case of central symmetry. The fundamental solution to the Dirichlet boundary value problem is found, and the solution to the problem under constant boundary value of temperature is studied. The integral transform technique is used. The solutions are obtained in terms of series containing the Mittag-Leffler functions being the generalization of the exponential function. The numerical results are illustrated graphically.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2018

Effects of Dufour and fractional derivative on unsteady natural convection flow over an infinite vertical plate with constant heat and mass fluxes

In this paper, we analyze the effects of Dufour number and fractional-order derivative on unsteady natural convection flow of a viscous and incompressible fluid over an infinite vertical plate with constant heat and mass fluxes. The fractional constitutive model is obtained using fractional calculus approach. The Caputo fractional derivative operator is used in this problem. The dimensionless system of equations has been solved by employing Laplace transformation technique. Closed form solutions for concentration, temperature and velocity are presented in the form of Wright function and complementary error function. Effects of fractional and physical parameters on temperature and velocity profiles are illustrated graphically.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2021

From NWChem to NWChemEx: Evolving with the Computational Chemistry Landscape

Since the advent of the first computers, chemists have been at the forefront of using computers to understand and solve complex chemical problems. As the hardware and software have evolved, so have the theoretical and computational chemistry methods and algorithms. Parallel computers clearly changed the common computing paradigm in the late 1970s and 80s, and the field has again seen a paradigm shift with the advent of graphical processing units. This review explores the challenges and some of the solutions in transforming software from the terascale to the petascale and now to the upcoming exascale computers. While discussing the field in general, NWChem and its redesign, NWChemEx, will be highlighted as one of the early codesign projects to take advantage of massively parallel computers and emerging software standards to enable large scientific challenges to be tackled.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

A GPU‐Based Ocean Dynamical Core for Routine Mesoscale‐Resolving Climate Simulations

Abstract We describe an ocean hydrostatic dynamical core implemented in Oceananigans optimized for Graphical Processing Unit (GPU) architectures. On 64 A100 GPUs, equivalent to 16 computational nodes in current state‐of‐the‐art supercomputers, our dynamical core can simulate a decade of near‐global ocean dynamics per wall‐clock day at an 8‐km horizontal resolution; a resolution adequate to resolve the ocean's mesoscale eddy field. Such efficiency, achieved with relatively modest hardware resources, suggests that climate simulations on GPUs can incorporate fully eddy‐resolving ocean models. This removes a major source of systematic bias in current IPCC coupled model projections, the parameterization of ocean eddies, and represents a major advance in climate modeling. We discuss the computational strategies, focusing on GPU‐specific optimization and numerical implementation details that enable such high performance.

Silvestri, Simone [Massachusetts Institute of Tech↗
DOE OSTI2014

Radiation and porosity effects on the magnetohydrodynamic flow near a vertical plate that applies shear stress to the fluid with mass diffusion

This article studies the radiation and porosity effects on the unsteady magnetohydrodynamic free convection flow of an incompressible viscous fluid past an infinite vertical plate that applies a shear stress f(t) to the fluid. Conjugate phenomenon of heat and mass transfer is considered. General solutions of the dimensionless governing equations along with imposed initial and boundary conditions are determined using Laplace transform technique. The solution of velocity is presented as a sum of mechanical and non mechanical parts. These solutions satisfy all imposed initial and boundary conditions and reduce to some known solutions from the literature as special cases. The results for embedded parameters are shown graphically. Numerical results for skin friction, Nusselt number and Sherwood number are computed and presented in tabular forms.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2020

Simulations of coherent scattering experiments at storage ring synchrotron radiation sources in the hard x-ray range

Detailed simulations of experiments carried out at modern light sources are directly related to the most efficient and productive use of these facilities for research in multiple branches of science and technology. The “Synchrotron Radiation Workshop” computer code with its Python interface, and Sirepo web-browser-based graphical user interface, currently supports physical optics simulations of coherent X-ray scattering and imaging experiments on user-defined virtual samples. We present examples of simulations of coherent scattering experiments that are typically performed at the Coherent Hard X-ray beamline at Brookhaven National Laboratory’s (BNL) National Synchrotron Light Source II. We also present several comparisons of the simulations with the results of actual coherent X-ray scattering experiments with nano-fabricated test samples produced at BNL’s Center for Functional Nanomaterials.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Modulating ion-binding at macromolecular interfaces during (bio)mineralization: A snapshot review for calcium carbonate and calcium phosphate systems

Abstract Local environments have strict influence over (bio)mineralization in calcifying systems. This snapshot review discusses recent insights into the roles of Ca 2+ -macromolecule interactions on the nucleation of calcium carbonate and calcium phosphate minerals. Experimental findings combined with simulations/modeling are providing breakthrough information and raising important questions for future studies. The emerging picture is that both nucleation and growth are driven by local ordering of ions and water about the macromolecule interface, rather than broader properties or molecular class. Tuning macromolecular properties at the atomic scale thus provides opportunities for highly specific controls on mineralization; however, many limitations and challenges remain. We highlight studies employing in-situ atomic force microscopy (AFM) and transmission electron microscopy (TEM) to observe crystallization processes on or near macromolecular substrates. As the distribution and ability of these techniques increases, fundamental studies integrating experimental and computational methods will be crucial to inform a broad range of applications. Graphical abstract

Knight, Brenna M. (ORCID:0000000244000067)↗
DOE OSTI2015

Stochastic Modeling of Radioactive Material Releases

Nonreactor nuclear facilities operated under the approval authority of the U.S. Department of Energy use unmitigated hazard evaluations to determine if potential radiological doses associated with design basis events challenge or exceed dose evaluation guidelines. Unmitigated design basis events that sufficiently challenge dose evaluation guidelines or exceed the guidelines for members of the public or workers, merit selection of safety structures, systems, or components or other controls to prevent or mitigate the hazard. Idaho State University, in collaboration with Idaho National Laboratory, has developed a portable and simple to use software application called SODA (Stochastic Objective Decision-Aide) that stochastically calculates the radiation dose associated with hypothetical radiological material release scenarios. Rather than producing a point estimate of the dose, SODA produces a dose distribution result to allow a deeper understanding of the dose potential. SODA allows users to select the distribution type and parameter values for all of the input variables used to perform the dose calculation. SODA then randomly samples each distribution input variable and calculates the overall resulting dose distribution. In cases where an input variable distribution is unknown, a traditional single point value can be used. SODA was developed using the MATLAB coding framework. The software application has a graphical user input. SODA can be installed on both Windows and Mac computers and does not require MATLAB to function. SODA provides improved risk understanding leading to better informed decision making associated with establishing nuclear facility material-at-risk limits and safety structure, system, or component selection. It is important to note that SODA does not replace or compete with codes such as MACCS or RSAC, rather it is viewed as an easy to use supplemental tool to help improve risk understanding and support better informed decisions. The work was funded through a grant from the DOE Nuclear Safety Research and Development Program.

61 RADIATION PROTECTION AND DOSIMETRY↗
DOE OSTI2016

NSR&D Program Fiscal Year 2015 Funded Research Stochastic Modeling of Radioactive Material Releases Final Report

Nonreactor nuclear facilities operating under the approval authority of the U.S. Department of Energy use unmitigated hazard evaluations to determine if potential radiological doses associated with design basis events challenge or exceed dose evaluation guidelines. Unmitigated design basis events that sufficiently challenge dose evaluation guidelines or exceed the guidelines for members of the public or workers, merit selection of safety structures, systems, or components or other controls to prevent or mitigate the hazard. Idaho State University, in collaboration with Idaho National Laboratory, has developed a portable and simple to use software application called SODA (Stochastic Objective Decision-Aide) that stochastically calculates the radiation dose distribution associated with hypothetical radiological material release scenarios. Rather than producing a point estimate of the dose, SODA produces a dose distribution result to allow a deeper understanding of the dose potential. SODA allows users to select the distribution type and parameter values for all of the input variables used to perform the dose calculation. Users can also specify custom distributions through a user defined distribution option. SODA then randomly samples each distribution input variable and calculates the overall resulting dose distribution. In cases where an input variable distribution is unknown, a traditional single point value can be used. SODA, developed using the MATLAB coding framework, has a graphical user interface and can be installed on both Windows and Mac computers. SODA is a standalone software application and does not require MATLAB to function. SODA provides improved risk understanding leading to better informed decision making associated with establishing nuclear facility material-at-risk limits and safety structure, system, or component selection. It is important to note that SODA does not replace or compete with codes such as MACCS or RSAC; rather it is viewed as an easy to use supplemental tool to help improve risk understanding and support better informed decisions. The SODA development project was funded through a grant from the DOE Nuclear Safety Research and Development Program.

42 ENGINEERING↗
DOE OSTI2021

EMPIRE-3.2 Nuclear reaction code system [Slides]

The presentation discusses the scope of EMPIRE, EMPIRE's convenience, the EMPIRE-3.2 (Malta) Nuclear Reaction Model Code, reaction models, and what is needed to improve EMPIRE's predictive power.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS1974

Time response simulation of the 1975 Viking Orbiter digital tape recorder

The objective of the present study was to verify and understand in depth the performance of the speed control (frequency loop) servo of the 1975 Viking Orbiter (VO75) digital tape recorder (DTR). The time response method employed is written in the continuous system simulation language (CSSL) for the Univac 1108 computer system. In order to demonstrate the power and flexibility of the graphic interactive simulation program, four aspects of system dynamics are interactively adjusted to arrive at a number of stable system configurations that have significantly different tape transport and/or summing amplifier gain, larger static/dynamic Coulomb friction, and different system lag than envisioned in the nominal design by linear methods. Work is currently underway to derive a new higher-order DST transfer function and to simulate the servo using state-space variable techniques.

Mukhopadhyay, A. K.↗
NASA NTRS1975

LUMIS: A Land Use Management Information System for urban planning

The Land Use Management Information System (LUMIS) consists of a methodology of compiling land use maps by means of air photo interpretation techniques, digitizing these and other maps into machine-readable form, and numerically overlaying these various maps in two computer software routines to provide land use and natural resource data files referenced to the individual census block. The two computer routines are the Polygon Intersection Overlay System (PIOS) and an interactive graphics APL program. A block referenced file of land use, natural resources, geology, elevation, slope, and fault-line items has been created and supplied to the Los Angeles Department of City Planning for the City's portion of the Santa Monica Mountains. In addition, the interactive system contains one hundred and seventy-three socio-economic data items created by merging the Third Count U.S. Census Bureau tapes and the Los Angeles County Secured Assessor File. This data can be graphically displayed for each and every block, block group, or tract for six test tracts in Woodland Hills, California. Other benefits of LUMIS are the knowledge of air photo availability, flight pattern coverage and frequencies, and private photogrammetry companies flying Southern California, as well as a formal Delphi study of relevant land use informational needs in the Santa Monicas.

Paul, C. K.↗
NASA NTRS1981

Timeline Resource Analysis Program (TRAP): User's manual and program document

The Timeline Resource Analysis Program (TRAP), developed for scheduling and timelining problems, is described. Given an activity network, TRAP generates timeline plots, resource histograms, and tabular summaries of the network, schedules, and resource levels. It is written in ANSI FORTRAN for the Honeywell SIGMA 5 computer and operates in the interactive mode using the TEKTRONIX 4014-1 graphics terminal. The input network file may be a standard SIGMA 5 file or one generated using the Interactive Graphics Design System. The timeline plots can be displayed in two orderings: according to the sequence in which the tasks were read on input, and a waterfall sequence in which the tasks are ordered by start time. The input order is especially meaningful when the network consists of several interacting subnetworks. The waterfall sequence is helpful in assessing the project status at any point in time.

Sessler, J. G.↗
NASA NTRS1982

Application of control theory to dynamic systems simulation

The application of control theory is applied to dynamic systems simulation. Theory and methodology applicable to controlled ecological life support systems are considered. Spatial effects on system stability, design of control systems with uncertain parameters, and an interactive computing language (PARASOL-II) designed for dynamic system simulation, report quality graphics, data acquisition, and simple real time control are discussed.

Auslander, D. M.↗
NASA NTRS1982

Large-area sheet task advanced dendritic web growth development

The computer code for calculating web temperature distribution was expanded to provide a graphics output in addition to numerical and punch card output. The new code was used to examine various modifications of the J419 configuration and, on the basis of the results, a new growth geometry was designed. Additionally, several mathematically defined temperature profiles were evaluated for the effects of the free boundary (growth front) on the thermal stress generation. Experimental growth runs were made with modified J419 configurations to complement the modeling work. A modified J435 configuration was evaluated.

Duncan, C. S.↗
NASA NTRS1983

ADAM: An Axisymmetric Duct Aeroacoustic Modeling system

An interconnected system of computer programs for analyzing the propagation and attenuation of sound in aeroengine ducts containing realistic compressible subsonic mean flows, ADAM was developed primarily for research directed towards the reduction of noise emitted from turbofan aircraft engines. The two basic components are a streamtube curvature program for determination of the mean flow, and a finite element code for solution of the acoustic propagation problem. The system, which has been specifically tailored for ease of use, is presently installed at NASA Langley Reseach Center on a Control Data Cyber 175 Computer under the NOS Operating system employing a Tektronix terminal for interactive graphics. The scope and organization of the ADAM system is described. A users guide, examples of input data, and results for selected cases are included.

Abrahamson, A. L.↗
NASA NTRS1984

Spatial information technologies for remote sensing today and tomorrow; Proceedings of the Ninth Pecora Symposium, Sioux Falls, SD, October 2-4, 1984

Topics discussed at the symposium include hardware, geographic information system (GIS) implementation, processing remotely sensed data, spatial data structures, and NASA programs in remote sensing information systems. Attention is also given GIS applications, advanced techniques, artificial intelligence, graphics, spatial navigation, and classification. Papers are included on the design of computer software for geographic image processing, concepts for a global resource information system, algorithm development for spatial operators, and an application of expert systems technology to remotely sensed image analysis.

Source record↗
NASA NTRS1986

Implicit hybrid schemes for the flux-difference split, three-dimensional Navier-Stokes equations

Implicit hybrid algorithms employing symmetric planar Gauss-Seidel (SPGS) relaxation and either block-tridiagonally structured coefficient matrices (AF-SPGS) or block-triangular coefficient matrices (LU-SPGS) are derived to solve the flux-difference-split Navier-Stokes equations for three-dimensional incompressible flow in an upwind scheme. The physical basis of the approach is discussed, and results for problems involving vortex flow around a thin delta wing at Reynolds numbers 900,000 and 10,000 are presented graphically. It is found that AF-SPGS converges faster on vector computers which depend on long vector lengths to achieve optimum performance, whereas LU-SPGS is preferable on sequentially operating machines and vector computers using shorter vector lengths.

Hartwich, P.-M.↗