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At least 1,207 records · Page 67

Preservation of kinetics parameters generated by Monte Carlo calculations in two-step deterministic calculations

The generation of accurate kinetic parameters such as mean generation time Λ and effective delayed neutron fraction β eff via Monte Carlo codes is established. Employing these in downstream deterministic codes warrants another step to ensure no additional error is introduced by the low-order transport operator when computing forward and adjoint fluxes for bilinear weighting of these parameters. Another complexity stems from applying superhomogenization (SPH) equivalence in non-fundamental mode approximations, where reference and low-order calculations rely on a 3D full core model. In these cases, SPH factors can optionally be computed for only part of the geometry while preserving reaction rates and K-effective, but the impact of such approximations on kinetics parameters has not been thoroughly studied. This paper aims at studying the preservation of bilinearly-weighted quantities in the Serpent–Griffin calculation procedure. Diffusion and transport evaluations of IPEN/MB-01, Godiva, and Flattop were carried out with the Griffin reactor physics code, testing available modeling options using Serpent-generated multigroup cross sections and equivalence data. Verifying Griffin against Serpent indicates sensitivities to multigroup energy grid selection and regional application of SPH equivalence, introducing significant errors; these were demonstrated to be reduced through the use of a transport method together with a finer energy grid.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

PyFLOSIC: Python-based Fermi–Löwdin orbital self-interaction correction

We present pyflosic, an open-source, general-purpose python implementation of the Fermi–Löwdin orbital self-interaction correction (FLO-SIC), which is based on the python simulation of chemistry framework (pyscf) electronic structure and quantum chemistry code. Thanks to pyscf, pyflosic can be used with any kind of Gaussian-type basis set, various kinds of radial and angular quadrature grids, and all exchange-correlation functionals within the local density approximation, generalized-gradient approximation (GGA), and meta-GGA provided in the libxc and xcfun libraries. A central aspect of FLO-SIC is the Fermi-orbital descriptors, which are used to estimate the self-interaction correction. Importantly, they can be initialized automatically within pyflosic; they can also be optimized within pyflosic with an interface to the atomic simulation environment, a python library that provides a variety of powerful gradient-based algorithms for geometry optimization. Although pyflosic has already facilitated applications of FLO-SIC to chemical studies, it offers an excellent starting point for further developments in FLO-SIC approaches, thanks to its use of a high-level programming language and pronounced modularity.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

A fast, matrix-based method to perform omnidirectional pressure integration

Abstract Experimentally-measured pressure fields play an important role in understanding many fluid dynamics problems. Unfortunately, pressure fields are difficult to measure directly with non-invasive, spatially resolved diagnostics, and calculations of pressure from velocity have proven sensitive to error in the data. Omnidirectional line integration methods are usually more accurate and robust to these effects as compared to implicit Poisson equations, but have seen slower uptake due to the higher computational and memory costs, particularly in 3D domains. This paper demonstrates how omnidirectional line integration approaches can be converted to a matrix inversion problem. This novel formulation uses an iterative approach so that the boundary conditions are updated each step, preserving the convergence behavior of omnidirectional schemes while also keeping the computational efficiency of Poisson solvers. This method is implemented in Matlab and also as a GPU-accelerated code in CUDA-C++. The behavior of the new method is demonstrated on 2D and 3D synthetic and experimental data. Three-dimensional grid sizes of up to 125 million grid points are tractable with this method, opening exciting opportunities to perform volumetric pressure field estimation from 3D PIV measurements.

42 ENGINEERING↗

The essential character of the neutrino mechanism of core-collapse supernova explosions

Abstract Calibrating with detailed 2D core-collapse supernova (CCSN) simulations, we derive a simple CCSN explosion condition based solely upon the terminal density profiles of state-of-the-art stellar evolution calculations of the progenitor massive stars. This condition captures the vast majority of the behaviour of the one hundred 2D state-of-the-art models we performed to gauge its usefulness. The goal is to predict, without resort to detailed simulation, the explodability of a given massive star. We find that the simple maximum fractional ram pressure jump discriminant we define works well ∼90 per cent of the time and we speculate on the origin of the few false positives and false negatives we witness. The maximum ram pressure jump generally occurs at the time of accretion of the silicon/oxygen interface, but not always. Our results depend upon the fidelity with which the current implementation of our code F ornax adheres to Nature and issues concerning the neutrino–matter interaction, the nuclear equation of state, the possible effects of neutrino oscillations, grid resolution, the possible role of rotation and magnetic fields, and the accuracy of the numerical algorithms employed remain to be resolved. Nevertheless, the explodability condition we obtain is simple to implement, shows promise that it might be further generalized while still employing data from only the unstable Chandrasekhar progenitors, and is a more credible and robust simple explosion predictor than can currently be found in the literature.

Astronomy & Astrophysics↗

Refactoring the elastic–viscous–plastic solver from the sea ice model CICE v6.5.1 for improved performance

This study focuses on the performance of the elastic–viscous–plastic (EVP) dynamical solver within the sea ice model, CICE v6.5.1. The study has been conducted in two steps. First, the standard EVP solver was extracted from CICE for experiments with refactored versions, which are used for performance testing. Second, one refactored version was integrated and tested in the full CICE model to demonstrate that the new algorithms do not significantly impact the physical results. The study reveals two dominant bottlenecks, namely (1) the number of Message Parsing Interface (MPI) and Open Multi-Processing (OpenMP) synchronization points required for halo exchanges during each time step combined with the irregular domain of active sea ice points and (2) the lack of single-instruction, multiple-data (SIMD) code generation. The standard EVP solver has been refactored based on two generic patterns. The first pattern exposes how general finite differences on masked multi-dimensional arrays can be expressed in order to produce significantly better code generation by changing the memory access pattern from random access to direct access. The second pattern takes an alternative approach to handle static grid properties. The measured single-core performance improvement is more than a factor of 5 compared to the standard implementation. The refactored implementation of strong scales on the Intel® Xeon® Scalable Processors series node until the available bandwidth of the node is used. For the Intel® Xeon® CPU Max series, there is sufficient bandwidth to allow the strong scaling to continue for all the cores on the node, resulting in a single-node improvement factor of 35 over the standard implementation. This study also demonstrates improved performance on GPU processors.

58 GEOSCIENCES↗

Applications of potential theory computations to transonic aeroelasticity

Unsteady aerodynamic and aeroelastic stability calculations based upon transonic small disturbance (TSD) potential theory are presented. Results from the two-dimensional XTRAN2L code and the three-dimensional XTRAN3S code are compared with experiment to demonstrate the ability of TSD codes to treat transonic effects. The necessity of nonisentropic corrections to transonic potential theory is demonstrated. Dynamic computational effects resulting from the choice of grid and boundary conditions are illustrated. Unsteady airloads for a number of parameter variations including airfoil shape and thickness, Mach number, frequency, and amplitude are given. Finally, samples of transonic aeroelastic calculations are given. A key observation is the extent to which unsteady transonic airloads calculated by inviscid potential theory may be treated in a locally linear manner.

Edwards, J. W.↗

Three-dimensional unsteady Euler solutions for propfans and counter-rotating propfans in transonic flow

An Euler code designed for computing the unsteady, three-dimensional, transonic flow about single-rotating and counter-rotating propfans using dynamic blocked-grids is presented. The algorithm is a finite volume, flux-split, upwind, implicit scheme and solves the equations which have been written in a time-dependent curvilinear coordinate system. Relative motion of the blades for counter-rotating configurations is handled by requiring that grid lines be aligned after each discrete rotation of fore and aft rotor grid blocks. The method by which information is passed across block interfaces, as well as how downstream characteristic outflow boundary conditions which enforce simple radial equilibrium are implemented, is discussed. Comparisons of computed flow-field parameters and propfan performance with experimental data indicate good overall agreement between predictions and measurements.

Whitfield, D. L.↗

The aerodynamic characteristics of vortex ingestion for the F/A-18 inlet duct

A Reduced Navier-Stokes (RNS) solution technique was successfully combined with the concept of partitioned geometry and mesh generation to form a very efficient 3D RNS code aimed at the analysis-design engineering environment. Partitioned geometry and mesh generation is a pre-processor to augment existing geometry and grid generation programs which allows the solver to (1) recluster an existing gridlife mesh lattice, and (2) perturb an existing gridfile definition to alter the cross-sectional shape and inlet duct centerline distribution without returning to the external geometry and grid generator. The present results provide a quantitative validation of the initial value space marching 3D RNS procedure and demonstrates accurate predictions of the engine face flow field, with a separation present in the inlet duct as well as when vortex generators are installed to supress flow separation. The present results also demonstrate the ability of the 3D RNS procedure to analyze the flow physics associated with vortex ingestion in general geometry ducts such as the F/A-18 inlet. At the conditions investigated, these interactions are basically inviscid like, i.e., the dominant aerodynamic characteristics have their origin in inviscid flow theory.

Anderson, Bernhard H.↗

The aerodynamic characteristics of vortex ingestion for the F/A-18 inlet duct

A Reduced Navier-Stokes (RNS) solution technique was successfully combined with the concept of partitioned geometry and mesh generation to form a very efficient 3-D RNS code aimed at the analysis-design engineering environment. Partitioned geometry and mesh generation is a pre-processor to augment existing geometry and grid generation programs which allows the solver to (1) recluster an existing gridlife mesh lattice, and (2) perturb an existing gridfile definition to alter the cross-sectional shape and inlet duct centerline distribution without returning to the external geometry and grid generator. The present results provide a quantitative validation of the initial value space marching 3-D RNS procedure and demonstrates accurate predictions of the engine face flow field, with a separation present in the inlet duct as well as when vortex generators are installed to suppress flow separation. The present results also demonstrate the ability of the 3-D RNS procedure to analyze the flow physics associated with vortex ingestion in general geometry ducts such as the F/A-18 inlet. At the conditions investigated, these interactions are basically inviscid like, i.e., the dominant aerodynamic characteristics have their origin in inviscid flow theory.

Anderson, Bernhard H.↗

Numerical models for the collapse and fragmentation of centrally condensed molecular cloud cores

The gravitational collapse and fragmentation of centrally condensed molecular cloud cores are investigated using a new hydrodynamical code. The numerical scheme is second-order accurate and uses explicit finite difference methods to advance the fluid variables on a 3D Cartesian grid. Two initial power-law density profiles, rho varies as r exp -1 and rho varies as r exp -2, are considered, as well as two initial density perturbations in the azimuthal coordinate theta, rho-i - rho(1 + a cos 2theta) where a = 0.1 and 0.5. Fragmentation is found to be possible in these centrally condensed cores if the initial conditions also include differential rotation. Models which collapse with initial uniform rotation do not produce fragments. If molecular cloud cores are indeed centrally condensed, as suggested by observations of star-forming regions and by studies of ambipolar diffusion, then differential rotation may be a mechanism for producing binary protostars during gravitational collapse.

Myhill, Elizabeth A.↗

Preliminary large-eddy simulations of flow around a NACA 4412 airfoil using unstructured grids

Large-eddy simulation (LES) has matured to the point where application to complex flows is desirable. The extension to higher Reynolds numbers leads to an impractical number of grid points with existing structured-grid methods. Furthermore, most real world flows are rather difficult to represent geometrically with structured grids. Unstructured-grid methods offer a release from both of these constraints. However, just as it took many years for structured-grid methods to be well understood and reliable tools for LES, unstructured-grid methods must be carefully studied before we can expect them to attain their full potential. In the past two years, important building blocks have been put into place making possible a careful study of LES on unstructured grids. The first building block was an efficient mesh generator which allowed the placement of points according to smooth variation of physical length scales. This variation of length scales is in all three directions independently, which allows a large reduction in points when compared to structured-grid methods, which can only vary length scales in one direction at a time. The second building block was the development of a dynamic model appropriate for unstructured grids. The principle obstacle was the development of an unstructured-grid filtering operator. In the past year, some of the new filters developed by Jansen have been implemented into a highly parallelized finite element code based on the Galerkin/least-squares finite element method. We have chosen the NACA 4412 airfoil at maximum lift as the first simulation for a variety of reasons. First, it is a problem of significant interest since it would be the first LES of an aircraft component. Second, this flow has been the subject of three experimental studies. The third reason for considering this flow is the variety of flow features which provide an important test of the dynamic model. Only the dynamic model can be expected to perform satisfactorily in this variety of situations: from the laminar regions where it must not modify the flow at all to the turbulent boundary layers and wake where it must represent a wide variety of subgrid-scale structures. The flow configuration we have chosen is that of Wadcock (1987) at Reynolds number based on chord Re(sub c) = u(sub infinity)c/v = 1.64 x 10(exp 6), Mach number M = 0.2, and 12 deg angle of attack.

Jansen, Kenneth↗

Land Surface Temperature Measurements from EOS MODIS Data

This report summarizes the accomplishments made by the MODIS LST (Land-Surface Temperature) group at University of California, Santa Barbara, under NASA Contract. Version 1 of the MODIS Land-Surface Temperature Algorithm Theoretical Basis Document (ATBD) was reviewed in June 1994, version 2 reviewed in November 1994, version 3.1 in August 1996, and version 3.3 updated in April 1999. Based on the ATBD, two LST algorithms were developed, one is the generalized split-window algorithm and another is the physics-based day/night LST algorithm. These two LST algorithms were implemented into the production generation executive code (PGE 16) for the daily standard MODIS LST products at level-2 (MODII-L2) and level-3 (MODIIA1 at 1 km resolution and MODIIB1 at 5km resolution). PGE codes for 8-day 1 km LST product (MODIIA2) and the daily, 8-day and monthly LST products at 0.05 degree latitude/longitude climate model grids (CMG) were also delivered. Four to six field campaigns were conducted each year since 2000 to validate the daily LST products generated by PGE16 and the calibration accuracies of the MODIS TIR bands used for the LST/emissivity retrieval from versions 2-4 of Terra MODIS data and versions 3-4 of Aqua MODIS data. Validation results from temperature-based and radiance-based methods indicate that the MODIS LST accuracy is better than 1 C in most clear-sky cases in the range from -10 to 58 C. One of the major lessons learn from multi- year temporal analysis of the consistent V4 daily Terra MODIS LST products in 2000-2003 over some selected target areas including lakes, snow/ice fields, and semi-arid sites is that there are variable numbers of cloud-contaminated LSTs in the MODIS LST products depending on surface elevation, land cover types, and atmospheric conditions. A cloud-screen scheme with constraints on spatial and temporal variations in LSTs was developed to remove cloud-contaminated LSTs. The 5km LST product was indirectly validated through comparisons to the 1 km LST product. Twenty three papers related to the LST research work were published in journals over the last decade.

Wan, Zheng-Ming↗

Navier-Stokes Computations and Experimental Comparisons for Multielement Airfoil Configurations

A two-dimensional unstructured Navier-Stokes code is utilized for computing the flow around multielement airfoil configurations. Comparisons are shown for a landing configuration with an advanced-technology flap. Grid convergence studies are conducted to assess inaccuracies caused by inadequate grid resolution. Although adequate resolution is obtained for determining the pressure distributions, further refinement is needed to sufficiently resolve the velocity profiles at high angles of attack. For the advanced flap configuration, comparisons of pressure distributions and lift are made with experimental data. Here, two flap riggings and two Reynolds numbers are considered. In general, the trends caused by variations in these quantities are well predicted by the computations, although the angle of attack for maximum lift is overpredicted.

Anderson, W. Kyle↗

Aeroelastic-Acoustics Simulation of Flight Systems

This paper describes the details of a numerical finite element (FE) based analysis procedure and a resulting code for the simulation of the acoustics phenomenon arising from aeroelastic interactions. Both CFD and structural simulations are based on FE discretization employing unstructured grids. The sound pressure level (SPL) on structural surfaces is calculated from the root mean square (RMS) of the unsteady pressure and the acoustic wave frequencies are computed from a fast Fourier transform (FFT) of the unsteady pressure distribution as a function of time. The resulting tool proves to be unique as it is designed to analyze complex practical problems, involving large scale computations, in a routine fashion.

Gupta, kajal K.↗

Multi-Fidelity Computational Analysis of a Quiet Single-Main Rotor Helicopter for Air Taxi Operations

A multi-fidelity computational study has been conducted on NASA’s quiet single-main rotor helicopter concept for urban air mobility using computational fluid dynamics and rotorcraft comprehensive analysis tools. Two approaches have been followed in order to simulate the rotor flows: (1) a rotor disk model, which models the rotors as source terms, and (2) a high-fidelity approach using high-order accurate schemes and dual-time stepping, which simulates the rotor with its individual rotating blade grids. The delayed detached-eddy simulation model has been employed. A loose-coupling approach between the flow solver and a rotorcraft comprehensive code is utilized to include vehicle trim and motion variables. The quiet single-main rotor helicopter is one of the conceptual designs intended to focus and guide NASA’s research activities in support of aircraft development for vertical take-off and landing air taxi operations.

RVLT↗

High-Fidelity Computational Analysis Of Nasa’s Air Taxi Concepts

High-fidelity Computational Fluid Dynamics (CFD) simulations have been carried out for NASA’s air taxi concepts. The high-fidelity approach uses high-order accurate schemes and dual-time stepping, which simulates the rotor with its individual rotating blade grids. The delayed detached-eddy simulation model has been employed. A loose-coupling approach between the flow solver and a rotorcraft comprehensive code is utilized to include vehicle trim and motion variables.NASA’s air taxi conceptual designs are intended to focus and guide NASA’s research activities in support of aircraft development for vertical take-off and landing air taxi operations

ARMD↗

Development of advanced Navier-Stokes solver

The objective of research was to develop and validate new computational algorithms for solving the steady and unsteady Euler and Navier-Stokes equations. The end-products are new three-dimensional Euler and Navier-Stokes codes that are faster, more reliable, more accurate, and easier to use. The three-dimensional Euler and full/thin-layer Reynolds-averaged Navier-Stokes equations for compressible/incompressible flows are solved on structured hexahedral grids. The Baldwin-Lomax algebraic turbulence model is used for closure. The space discretization is based on a cell-centered finite-volume method augmented by a variety of numerical dissipation models with optional total variation diminishing limiters. The governing equations are integrated in time by an implicit method based on lower-upper factorization and symmetric Gauss-Seidel relaxation. The algorithm is vectorized on diagonal planes of sweep using two-dimensional indices in three dimensions. Convergence rates and the robustness of the codes are enhanced by the use of an implicit full approximation storage multigrid method.

Yoon, Seokkwan↗

Code IN Exhibits - Supercomputing 2000

The creation of parameter study suites has recently become a more challenging problem as the parameter studies have become multi-tiered and the computational environment has become a supercomputer grid. The parameter spaces are vast, the individual problem sizes are getting larger, and researchers are seeking to combine several successive stages of parameterization and computation. Simultaneously, grid-based computing offers immense resource opportunities but at the expense of great difficulty of use. We present ILab, an advanced graphical user interface approach to this problem. Our novel strategy stresses intuitive visual design tools for parameter study creation and complex process specification, and also offers programming-free access to grid-based supercomputer resources and process automation.

Yarrow, Maurice↗