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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 145 records · Page 8

On signal design by the R sub 0 criterion for non-white Gaussian noise channels

The use of the R sub 0 criterion for modulation system design is investigated for channels with non-white Gaussian noise. A signal space representation of the waveform channel is developed, and the cut-off rate R sub 0 for vector channels with additive nonwhite Gaussian noise and unquantized demodulation is derived. When the signal unput to the channel is a continuous random vector, maximization of R sub 0 with constrained average signal energy leads to a water-filling interpretation of optimal energy distribution in signal space. The necessary condition for a finite signal set to maximize R sub 0 with constrained energy and an equally likely probability assignment of signal vectors is presented, and an algorithm is outlined for numerically computing the optimum signal set. A necessary condition on a constrained energy, finite signal set is found which maximizes a Taylor series approximation of R sub 0. This signal set is compared with the finite signal set which has the water-filling average energy distribution.

Bordelon, D. L.↗

On signal design by the R/0/ criterion for non-white Gaussian noise channels

The use of the cut-off rate criterion for modulation system design is investigated for channels with non-white Gaussian noise. A signal space representation of the waveform channel is developed, and the cut-off rate for vector channels with additive non-white Gaussian noise and unquantized demodulation is derived. When the signal input to the channel is a continuous random vector, maximization of the cut-off rate with constrained average signal energy leads to a water-filling interpretation of optimal energy distribution in signal space. The necessary condition for a finite signal set to maximize the cut-off rate with constrained energy and an equally likely probability assignment of signal vectors is presented, and an algorithm is outlined for numerically computing the optimum signal set. As an example, the rectangular signal set which has the water-filling average energy distribution and the optimum rectangular set are compared.

Bordelon, D. L.↗

Development of a unified numerical procedure for free vibration analysis of structures

This paper presents the details of a unified numerical algorithm and the associated computer program developed for the efficient determination of natural frequencies and modes of free vibration of structures. Both spinning and nonspinning structures with or without viscous and/or structural damping may be solved by the current procedure; in addition, the program is capable of solving static problems with multiple load cases as well as the quadratic matrix eigenproblem associated with a finite dynamic element structural discretization.

Gupta, K. K.↗

Progress toward the analysis of complex propulsion installation flow phenomenon

A trend toward replacement of parametric model testing with parametric analysis for the design of aircraft is driven by the rapidly escalating cost of wind tunnel testing, the increasing availability of large fast computers, and powerful numerical flow algorithms. In connection with the complex flow phenomena characteristic of propulsion installations, it is now necessary to employ both parametric analysis and testing for design procedures. Powerful flow analysis techniques are available to predict local flow phenomena. However, the employment of these techniques is very expensive. It is, therefore, necessary to link these analyses with less powerful and less expensive procedures for an accurate analysis of propulsion installation flowfields. However, the interfacing and coupling processes needed are not available. The present investigation is concerned with progress made regarding the development of suitable linking methods. Attention is given to methods of analysis for predicting the flow around a nacelle coupled to a highly swept wing.

Kern, P. R. A.↗

BEM for wave equation with boundary in arbitrary motion and applications to compressible potential aerodynamics of airplanes and helicopters

The wave equation for an object in arbitrary motion is investigated analytically using a BEM approach, and practical applications to potential flows of compressible fluids around aircraft wings and helicopter rotors are considered. The treatment accounts for arbitrary combined rotational and translational motion of the reference frame and for the wake motion. The numerical implementation as a computer algorithm is demonstrated on problems with prescribed and free wakes, the former in compressible flows and the latter for incompressible flows; results are presented graphically and briefly characterized.

Morino, Luigi↗

Two-time scale stabilization of a flexible arm with output feedback

An approach is presented to designing a control system with output feedback for a lightweight flexible arm. A two-time-scale dynamic model is obtained which allows the adoption of a composite control strategy. First a slow control can be designed for the slow (rigid) subsystem, and then a fast stabilizing control for the fast (flexible) subsystem. The problem of the lack of full state measurements connected with the fast control design is solved. An output-feedback, low-order dynamic compensator whose optimal gains are computed by a convergent numerical algorithm is designed. A more robust design can be achieved if a loop transfer recovery procedure is introduced. The design procedure is tested by means of nonlinear simulation, and the results are discussed.

Siciliano, Bruno↗

Volume 2: Explicit, multistage upwind schemes for Euler and Navier-Stokes equations

The objective of this study was to develop a high-resolution-explicit-multi-block numerical algorithm, suitable for efficient computation of the three-dimensional, time-dependent Euler and Navier-Stokes equations. The resulting algorithm has employed a finite volume approach, using monotonic upstream schemes for conservation laws (MUSCL)-type differencing to obtain state variables at cell interface. Variable interpolations were written in the k-scheme formulation. Inviscid fluxes were calculated via Roe's flux-difference splitting, and van Leer's flux-vector splitting techniques, which are considered state of the art. The viscous terms were discretized using a second-order, central-difference operator. Two classes of explicit time integration has been investigated for solving the compressible inviscid/viscous flow problems--two-state predictor-corrector schemes, and multistage time-stepping schemes. The coefficients of the multistage time-stepping schemes have been modified successfully to achieve better performance with upwind differencing. A technique was developed to optimize the coefficients for good high-frequency damping at relatively high CFL numbers. Local time-stepping, implicit residual smoothing, and multigrid procedure were added to the explicit time stepping scheme to accelerate convergence to steady-state. The developed algorithm was implemented successfully in a multi-block code, which provides complete topological and geometric flexibility. The only requirement is C degree continuity of the grid across the block interface. The algorithm has been validated on a diverse set of three-dimensional test cases of increasing complexity. The cases studied were: (1) supersonic corner flow; (2) supersonic plume flow; (3) laminar and turbulent flow over a flat plate; (4) transonic flow over an ONERA M6 wing; and (5) unsteady flow of a compressible jet impinging on a ground plane (with and without cross flow). The emphasis of the test cases was validation of code, and assessment of performance, as well as demonstration of flexibility.

Elmiligui, Alaa↗

First and second order approximations to stage numbers in multicomponent enrichment cascades

This paper describes closed form, Taylor series approximations to the number product stages in a multicomponent enrichment cascade. Such closed form approximations are required when a symbolic, rather than a numeric, algorithm is used to compute the optimal cascade state. Both first and second order approximations were implemented. The first order solution was found to be grossly incorrect, having the wrong functional form over the entire domain. On the other hand, the second order solution shows excellent agreement with the 'true' solution over the domain of interest. An implementation of the symbolic, second order solver is available in the free and open source PyNE library. (authors)

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Computing molecular excited states on a D-Wave quantum annealer

Abstract The possibility of using quantum computers for electronic structure calculations has opened up a promising avenue for computational chemistry. Towards this direction, numerous algorithmic advances have been made in the last five years. The potential of quantum annealers, which are the prototypes of adiabatic quantum computers, is yet to be fully explored. In this work, we demonstrate the use of a D-Wave quantum annealer for the calculation of excited electronic states of molecular systems. These simulations play an important role in a number of areas, such as photovoltaics, semiconductor technology and nanoscience. The excited states are treated using two methods, time-dependent Hartree–Fock (TDHF) and time-dependent density-functional theory (TDDFT), both within a commonly used Tamm–Dancoff approximation (TDA). The resulting TDA eigenvalue equations are solved on a D-Wave quantum annealer using the Quantum Annealer Eigensolver (QAE), developed previously. The method is shown to reproduce a typical basis set convergence on the example $$\hbox {H}_2$$ H 2 molecule and is also applied to several other molecular species. Characteristic properties such as transition dipole moments and oscillator strengths are computed as well. Three potential energy profiles for excited states are computed for $$\hbox {NH}_3$$ NH 3 as a function of the molecular geometry. Similar to previous studies, the accuracy of the method is dependent on the accuracy of the intermediate meta-heuristic software called qbsolv.

74 ATOMIC AND MOLECULAR PHYSICS↗

The NOAA-9 Earth Radiation Budget Experiment Wide Field-of-View Data Set

The Earth Radiation Budget Experiment (ERBE) consisted of wide field-of-view (WFOV) radiometers and scanning radiometers for measuring outgoing longwave radiation and solar radiation reflected from the Earth. These instruments were carried by the dedicated Earth Radiation Budget Satellite (ERBS) and by the NOAA-9 and -10 operational spacecraft. The WFOV radiometers provided data from which instantaneous fluxes at the top of the atmosphere (TOA) are computed by use of a numerical filter algorithm. Monthly mean fluxes over a 5-degree equal angle grid are computed from the instantaneous TOA fluxes. The WFOV radiometers aboard the NOAA-9 spacecraft operated from February 1985 through December 1992, at which time a failure of the shortwave radiometer ended the usable data after nearly 8 years. This paper examines the monthly mean products from that data set.

Bush, Kathryn A.↗

Exascale applications: skin in the game

As noted in Wikipedia, skin in the game refers to having ‘incurred risk by being involved in achieving a goal’, where ‘ skin is a synecdoche for the person involved, and game is the metaphor for actions on the field of play under discussion’. For exascale applications under development in the US Department of Energy Exascale Computing Project, nothing could be more apt, with the skin being exascale applications and the game being delivering comprehensive science-based computational applications that effectively exploit exascale high-performance computing technologies to provide breakthrough modelling and simulation and data science solutions. These solutions will yield high-confidence insights and answers to the most critical problems and challenges for the USA in scientific discovery, national security, energy assurance, economic competitiveness and advanced healthcare. This article is part of a discussion meeting issue ‘Numerical algorithms for high-performance computational science’.

97 MATHEMATICS AND COMPUTING↗

A proposed study of multiple scattering through clouds up to 1 THz

A rigorous computation of the electromagnetic field scattered from an atmospheric liquid water cloud is proposed. The recent development of a fast recursive algorithm (Chew algorithm) for computing the fields scattered from numerous scatterers now makes a rigorous computation feasible. A method is presented for adapting this algorithm to a general case where there are an extremely large number of scatterers. It is also proposed to extend a new binary PAM channel coding technique (El-Khamy coding) to multiple levels with non-square pulse shapes. The Chew algorithm can be used to compute the transfer function of a cloud channel. Then the transfer function can be used to design an optimum El-Khamy code. In principle, these concepts can be applied directly to the realistic case of a time-varying cloud (adaptive channel coding and adaptive equalization). A brief review is included of some preliminary work on cloud dispersive effects on digital communication signals and on cloud liquid water spectra and correlations.

Gerace, G. C.↗

Applications of the worldline Monte Carlo formalism in quantum mechanics

Highlights: Universal approach to the numerical computation of the Euclidean path integral. Inspired by recent work in relativistic quantum field theory. Here adapted to non-relativistic quantum mechanics. Worked out for the computation of propagators and ground-state energies. Special smoothing procedure for singular potentials. -- Abstract: In recent years efficient algorithms have been developed for the numerical computation of relativistic single-particle path integrals in quantum field theory. Here, we adapt this “worldline Monte Carlo” approach to the standard problem of the numerical approximation of the non-relativistic path integral, resulting in a formalism whose characteristic feature is the fast, non-recursive generation of an ensemble of trajectories that is independent of the potential, and is thus universally applicable. The numerical implementation discretises the trajectories with respect to their time parametrisation but maintains a continuous spatial domain. In the case of singular potentials, the discretised action gets adapted to the singularity through a “smoothing” procedure. We show for a variety of examples (the harmonic oscillator in various dimensions, the modified Pöschl–Teller potential, delta-function potentials, the Coulomb and Yukawa potentials) that the method allows one to obtain fast and reliable estimates for the Euclidean propagator and use them in a certain time window suitable for extracting the ground state energy. Usually Monte Carlo calculations in quantum mechanics are performed using algorithms that involve a more specific adaptation to the potential, and we briefly compare our method with the most widely used such algorithms, which are of Metropolis type. As an aside, we apply it for studying the classical limit where nearly classical trajectories are expected to dominate in the path integral. We expect the advances made here to be useful also in the relativistic case.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

An efficient implementation of the Chebyshev Rational Approximation Method (CRAM) for solving the burnup equations

The Chebyshev Rational Approximation Method (CRAM) has been recently introduced by the authors for solving the burnup equations with excellent results. This method has been shown to be capable of simultaneously solving an entire burnup system with thousands of nuclides both accurately and efficiently. The method was prompted by an analysis of the spectral properties of burnup matrices and it can be characterized as the best rational approximation on the negative real axis. The coefficients of the rational approximation are fixed and have been reported for various approximation orders. In addition to these coefficients, implementing the method only requires a linear solver. This paper describes an efficient method for solving the linear systems associated with the CRAM approximation. The introduced direct method is based on sparse Gaussian elimination where the sparsity pattern of the resulting upper triangular matrix is determined before the numerical elimination phase. The stability of the proposed Gaussian elimination method is discussed based on considering the numerical properties of burnup matrices. Suitable algorithms are presented for computing the symbolic factorization and numerical elimination in order to facilitate the implementation of CRAM and its adoption into routine use. The accuracy and efficiency of the described technique are demonstrated by computing the CRAM approximations for a large test case with over 1600 nuclides. (authors)

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Design and implementation of a parallel unstructured Euler solver using software primitives

This paper is concerned with the implementation of a three-dimensional unstructured-grid Euler solver on massively parallel distributed-memory computer architectures. The goal is to minimize solution time by achieving high computational rates with a numerically efficient algorithm. An unstructured multigrid algorithm with an edge-based data structure has been adopted, and a number of optimizations have been devised and implemented to accelerate the parallel computational rates. The implementation is carried out by creating a set of software tools, which provide an interface between the parallelization issues and the sequential code, while providing a basis for future automatic run-time compilation support. Large practical unstructured grid problems are solved on the Intel iPSC/860 hypercube and Intel Touchstone Delta machine. The quantitative effects of the various optimizations are demonstrated, and we show that the combined effect of these optimizations leads to roughly a factor of 3 performance improvement. The overall solution efficiency is compared with that obtained on the Cray Y-MP vector supercomputer.

Das, R.↗

On the numerical computation of nonlinear force-free magnetic fields

An algorithm has been developed to extrapolate nonlinear force-free magnetic fields from a source surface, given the proper boundary conditions. The results of this work; describing the mathematical formalism that was developed, the numerical techniques employed, and the stability criteria developed for these numerical schemes are presented. An analytical solution is used for a test case; the results show that the computational accuracy for the case of a nonlinear force-free magnetic field was on the order of a few percent ( 5%).

Wu, S. T.↗

The design and implementation of a parallel unstructured Euler solver using software primitives

This paper is concerned with the implementation of a 3D unstructured-grid Euler-solver on massively parallel distributed-memory computer architectures. The goal is to minimize solution time by achieving high computational rates with a numerically efficient algorithm. An unstructured multigrid algorithm with an edge-based data-structure has been adopted, and a number of optimizations have been devised and implemented in order to accelerate the parallel computational rates. The implementation is carried out by creating a set of software tools, which ease the implementation of computational problems on parallel architecture machines by relieving the user of the low-level machine specific issues. The quantitative effect of the various optimizations are demonstrated, and we show that the combined effect of these optimizations leads to roughly a factor of three performance improvement. The overall solution efficiency is compared with that obtained on the CRAY-YMP vector supercomputer.

Das, R.↗

Parallel language constructs for tensor product computations on loosely coupled architectures

A set of language primitives designed to allow the specification of parallel numerical algorithms at a higher level is described. The authors focus on tensor product array computations, a simple but important class of numerical algorithms. They consider first the problem of programming one-dimensional kernel routines, such as parallel tridiagonal solvers, and then look at how such parallel kernels can be combined to form parallel tensor product algorithms.

Mehrotra, Piyush↗