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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 361 records · Page 20

Exponential Improvements in the Simulation of Lattice Gauge Theories Using Near-Optimal Techniques

We report a first-of-its-kind analysis on post-Trotter simulation of U(1), SU(2), and SU(3) lattice gauge theories including fermions in arbitrary spatial dimension. We provide explicit circuit constructions as well as T-gate counts and logical qubit counts for Hamiltonian simulation. We find a reduction of up to 25 orders of magnitude in space-time volume over Trotter methods for simulations of non-Abelian lattice gauge theories relevant to the standard model. This improvement results from our algorithm having polynomial scaling with the number of colors in the gauge theory, achieved by utilizing oracle constructions relying on the sparsity of physical operators, in contrast to the exponential scaling seen in state-of-the-art Trotter methods, which employ explicit mappings onto Pauli operators. Our work demonstrates that the use of advanced algorithmic techniques leads to dramatic reductions in the cost of simulating fundamental interactions, bringing it in step with resources required for first-principles quantum simulation of chemistry.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

A Time Integration Algorithm Based on the State Transition Matrix for Structures with Time Varying and Nonlinear Properties

A variable order method of integrating the structural dynamics equations that is based on the state transition matrix has been developed. The method has been evaluated for linear time variant and nonlinear systems of equations. When the time variation of the system can be modeled exactly by a polynomial it produces nearly exact solutions for a wide range of time step sizes. Solutions of a model nonlinear dynamic response exhibiting chaotic behavior have been computed. Accuracy of the method has been demonstrated by comparison with solutions obtained by established methods.

Bartels, Robert E.↗

S -matrix positivity without Lorentz invariance: a case study

We investigate the analytic structure of scattering amplitudes in theories in which Lorentz invariance is spontaneously broken. We do so by computing and studying the S-matrix for a simple example: a superfluid described by a complex scalar with quartic interactions. The computation is confined to tree-level, for there are no absolutely stable single-particle states, though the lifetime can be made long by lowering the chemical potential. For the 2 → 2 amplitude in center-of-mass configurations, not only is crossing symmetry violated, there appears a tree level branch cut for unphysical kinematics. Its appearance is a consequence of non-analyticity in the dispersion relation. The branch point defines a new scale in the problem, which scales inversely with the chemical potential. In this example, even derivatives of the forward amplitude are positive while odd derivatives are negative. This pattern can be understood in a general way in the limit of a small chemical potential, or weak Lorentz breaking.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Codiscovering graphical structure and functional relationships within data: A Gaussian Process framework for connecting the dots

Most problems within and beyond the scientific domain can be framed into one of the following three levels of complexity of function approximation. Type 1: Approximate an unknown function given input/output data. Type 2: Consider a collection of variables and functions, some of which are unknown, indexed by the nodes and hyperedges of a hypergraph (a generalized graph where edges can connect more than two vertices). Given partial observations of the variables of the hypergraph (satisfying the functional dependencies imposed by its structure), approximate all the unobserved variables and unknown functions. Type 3: Expanding on Type 2, if the hypergraph structure itself is unknown, use partial observations of the variables of the hypergraph to discover its structure and approximate its unknown functions. These hypergraphs offer a natural platform for organizing, communicating, and processing computational knowledge. While most scientific problems can be framed as the data-driven discovery of unknown functions in a computational hypergraph whose structure is known (Type 2), many require the data-driven discovery of the structure (connectivity) of the hypergraph itself (Type 3). We introduce an interpretable Gaussian Process (GP) framework for such (Type 3) problems that does not require randomization of the data, access to or control over its sampling, or sparsity of the unknown functions in a known or learned basis. Its polynomial complexity, which contrasts sharply with the super-exponential complexity of causal inference methods, is enabled by the nonlinear ANOVA capabilities of GPs used as a sensing mechanism.

Science & Technology - Other Topics↗

Linearised Fokker–Planck collision model for gyrokinetic simulations

We introduce a gyrokinetic, linearised Fokker–Planck collision model that satisfies conservation laws and is accurate at arbitrary collisionalities. The differential test-particle component of the operator is exact; the integral field-particle component is approximated using a spherical harmonic and a modified Laguerre polynomial expansion developed by Hirshman and Sigmar (1976 Phys. Fluids 19 1532). The numerical methods of the implementation in the δf-gyrokinetic code stella (Barnes et al 2019 J. Comput. Phys. 391 365–80) are discussed, and conservation properties of the operator are demonstrated. The collision model is then benchmarked against the collision model of the gyrokinetic solver GS2 in the limiting cases of a reduced test-particle collision operator and energy- and momentum-conserving operator. The accuracy of the full collision model is investigated by solving the parallel Spitzer-Härm problem for the transport coefficients. It is shown that retaining collisional energy flux and higher-order terms in the field-particle operator reduces errors in the transport coefficients from 10%–25% for a simple momentum- and energy-conserving model to under 1%.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

On the numerical solution of time-dependent viscous incompressible fluid flows involving solid boundaries

An inherent numerical problem associated with the fully explicit pseudospectral numerical simulation of the incompressible Navier-Stokes equation for viscous flows with no-slip walls is described. A semi-implicit scheme which circumvents this numerical difficulty is presented. In this algorithm the equation of continuity rather than the Poisson equation for pressure is solved directly. Pseudospectral formulation of the channel flow problem using Fourier series and Chebyshev polynomials expansions is given for this scheme. An example demonstrating the applicability of the method is given.

Moin, P.↗

Evaluation of closed cubic failure criterion for graphite/epoxy laminates

An analytical method has been developed to ensure closure of the cubic form of the tensor polynomial strength criterion. The intrinsic complexity of the cubic function is such that special conditions must be met to close the failure surface in three-dimensional stress space. These requirements are derived in terms of non-intersecting conditions for asymptotes and an asymptotic plane. To demonstrate the validity of this approach, closed failure surfaces were derived for two graphite/epoxy material systems (3M SP288-T300 and IM7 8551-7). The agreement of test data with this model clearly shows that it is possible to use a higher order cubic failure theory with confidence.

Tennyson, R. C.↗

On three dimensional object recognition and pose-determination: An abstraction based approach

A method of computing reliable Gaussian and mean curvature sign-map descriptors from the polynomial approximation of surfaces was demonstrated. Such descriptors which are invariant under perspective variation are suitable for hypothesis generation. A means for determining the pose of constructed geometric forms whose algebraic surface descriptors are nonlinear in terms of their orienting parameters was developed. This was done by means of linear functions which are capable of approximating nonlinear forms and determining their parameters. It was shown that biquadratic surfaces are suitable companion linear forms for cylindrical approximation and parameter estimation. The estimates provided the initial parametric approximations necessary for a nonlinear regression stage to fine tune the estimates by fitting the actual nonlinear form to the data. A hypothesis-based split-merge algorithm for extraction and pose determination of cylinders and planes which merge smoothly into other surfaces was developed. It was shown that all split-merge algorithms are hypothesis-based. A finite-state algorithm for the extraction of the boundaries of run-length regions was developed. The computation takes advantage of the run list topology and boundary direction constraints implicit in the run-length encoding.

Quek, Kok How Francis↗

A finite-volume high-order ENO scheme for two-dimensional hyperbolic systems

The finite-volume approach is presently used to obtain a 2D, high-order accurate and basically nonoscillatory shock-capture method whose high-order spatial accuracy is obtained by means of a piecewise polynomial approximation of the solution from cell averages. Attention is given to a high-order spatial operator that is able to both retain high-order accuracy in smooth regions and avoid the oscillations that are associated with interpolations across steep gradients. The operator is extended to hyperbolic systems of equations and curvilinear meshes.

Casper, Jay↗

Comparison of Implicit Collocation Methods for the Heat Equation

We combine a high-order compact finite difference scheme to approximate spatial derivatives arid collocation techniques for the time component to numerically solve the two dimensional heat equation. We use two approaches to implement the collocation methods. The first one is based on an explicit computation of the coefficients of polynomials and the second one relies on differential quadrature. We compare them by studying their merits and analyzing their numerical performance. All our computations, based on parallel algorithms, are carried out on the CRAY SV1.

Kouatchou, Jules↗

On the Development of an Efficient Parallel Hybrid Solver with Application to Acoustically Treated Aero-Engine Nacelles

A finite element solution to the convected Helmholtz equation in a nonuniform flow is used to model the noise field within 3-D acoustically treated aero-engine nacelles. Options to select linear or cubic Hermite polynomial basis functions and isoparametric elements are included. However, the key feature of the method is a domain decomposition procedure that is based upon the inter-mixing of an iterative and a direct solve strategy for solving the discrete finite element equations. This procedure is optimized to take full advantage of sparsity and exploit the increased memory and parallel processing capability of modern computer architectures. Example computations are presented for the Langley Flow Impedance Test facility and a rectangular mapping of a full scale, generic aero-engine nacelle. The accuracy and parallel performance of this new solver are tested on both model problems using a supercomputer that contains hundreds of central processing units. Results show that the method gives extremely accurate attenuation predictions, achieves super-linear speedup over hundreds of CPUs, and solves upward of 25 million complex equations in a quarter of an hour.

Watson, Willie R.↗

Guidance and control strategies for aerospace vehicles

A simplified method of matched asymptotic expansions was developed where the common part in composite solution is generated as a polynomial in stretched variable instead of actually evaluating the same from the outer solution. This methodology was applied to the solution of the exact equations for three dimensional atmospheric entry problems. Compared to previous works, the present simplified methodology yields explicit analytical expressions for various components of the composite solution without resorting to any type of transcendental equations to be solved only by numerical methods. The optimal control problem arising in the noncoplanar orbital transfer employing aeroassist was also addressed.

Hibey, Joseph L.↗

Lifting MGARD: Construction of (pre)wavelets on the interval using polynomial predictors of arbitrary order

MGARD (MultiGrid Adaptive Reduction of Data) is an algorithm for compressing and refactoring scientific data, based on the theory of multigrid methods. The core algorithm is built around stable multilevel decompositions of conforming piecewise linear $C^0$ finite element spaces, enabling accurate error control in various norms and derived quantities of interest. In this work, we extend this construction to arbitrary order Lagrange finite elements $\mathbb{Q}_p$, $p \geq 0$, and propose a reformulation of the algorithm as a lifting scheme with polynomial predictors of arbitrary order. Additionally, a new formulation using a compactly supported wavelet basis is discussed, and an explicit construction of the proposed wavelet transform for uniform dyadic grids is described.

Reshniak, Viktor [Oak Ridge National Laboratory (O↗

A Bayesian Framework for Spectral Reprojection

Abstract Fourier partial sum approximations yield exponential accuracy for smooth and periodic functions, but produce the infamous Gibbs phenomenon for non-periodic ones. Spectral reprojection resolves the Gibbs phenomenon by projecting the Fourier partial sum onto a Gibbs complementary basis, often prescribed as the Gegenbauer polynomials. Noise in the Fourier data and the Runge phenomenon both degrade the quality of the Gegenbauer reconstruction solution, however. Motivated by its theoretical convergence properties, this paper proposes a new Bayesian framework for spectral reprojection, which allows a greater understanding of the impact of noise on the reprojection method from a statistical point of view. We are also able to improve the robustness with respect to the Gegenbauer polynomials parameters. Finally, the framework provides a mechanism to quantify the uncertainty of the solution estimate.

Li, Tongtong (ORCID:0000000276644764)↗

A Galerkin method for linear PDE systems in circular geometries with structural acoustic applications

A Galerkin method for systems of PDE's in circular geometries is presented with motivating problems being drawn from structural, acoustic, and structural acoustic applications. Depending upon the application under consideration, piecewise splines or Legendre polynomials are used when approximating the system dynamics with modifications included to incorporate the analytic solution decay near the coordinate singularity. This provides an efficient method which retains its accuracy throughout the circular domain without degradation at singularity. Because the problems under consideration are linear or weakly nonlinear with constant or piecewise constant coefficients, transform methods for the problems are not investigated. While the specific method is developed for the two dimensional wave equations on a circular domain and the equation of transverse motion for a thin circular plate, examples demonstrating the extension of the techniques to a fully coupled structural acoustic system are used to illustrate the flexibility of the method when approximating the dynamics of more complex systems.

Smith, Ralph C.↗

Two-dimensional radiation and scattering at short wave length

In the present investigation of radiation and scattering by objects when the wavelengths are much smaller than the characteristic dimensions of the radiator or scatterer, the boundary-element method is used to obtain computational accuracy and efficiency. The approach employed for wavelengths less than 5 percent of object characteristic dimensions involves cubic elements, approximate polynomial and asymptotic evaluations of the fundamental solution, and a tailoring of the order of the Gaussian quadrature according to the local demands dictated by the distance between sending and receiving points. The method addresses the propagation of low-frequency sound over large terrain features.

Yoon, W. S.↗

High-Order Simulation of Non-Linear Oscillations and Shocks in the Solar Atmosphere

The solar atmosphere presents a rich source of highly non-linear magneto-hydrodynamic phenomena: strong gradients and forcing terms result in both large shocks and oscillations. The additional requirements of energy balance and initialization in hydrostatic equilibrium compound the challenge of this problem. A wealth of observational data allows us to check the results of our simulations. The problem of simulating the solar atmosphere provides, in addition to an interesting system in its own right, a challenging testbed for high-order shock-capturing methods. We discuss the challenge of simulating solar atmospheric phenomena, concentrating on various high-order central methods ranging from second to fourth order. Our method is based on the central-upwind scheme of Kurganov, Noelle and Petrova, which we extend to high order via various interpolants. We investigate various initial data for our simulations, corresponding to observed conditions in different regions of the solar surface: the normal quiet sun and sunspots. When non-oscillatory using second- and third-order methods, we are able to reproduce non-trivial observational results. In particular we find a correlation between initial data and both the shock speeds and particle oscillation spectra that match observations in the corresponding regions. When using fourth-order WENO interpolants, we find that while the individual shock profiles at any given time appear non-oscillatory, spurious oscillations appear in the fields after long time integrations. The issue of initialization in hydrostatic equilibrium raises difficult issues. Careful treatment of the gravitational source term can reduce violations of hydrostatic equilibrium, but difficulties remain, primarily due to discontinuities in the piecewise-polynomial reconstructions. In the case of the Euler equations in gravity, the use of high-order methods reduces the violation of hydrostatic equilibrium to a sufficiently low level for the above described results to be obtained. Including various energy flux terms in the equations, however, leads to severe instability when hydrostatic balance is violated. We discuss various strategies to address this problem, including adaptive grid methods.

Bryson, S.↗