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NASA NTRS1994

Spectral Methods for Computational Fluid Dynamics

As a tool for large-scale computations in fluid dynamics, spectral methods were prophesized in 1944, born in 1954, virtually buried in the mid-1960's, resurrected in 1969, evangalized in the 1970's, and catholicized in the 1980's. The use of spectral methods for meteorological problems was proposed by Blinova in 1944 and the first numerical computations were conducted by Silberman (1954). By the early 1960's computers had achieved sufficient power to permit calculations with hundreds of degrees of freedom. For problems of this size the traditional way of computing the nonlinear terms in spectral methods was expensive compared with finite-difference methods. Consequently, spectral methods fell out of favor. The expense of computing nonlinear terms remained a severe drawback until Orszag (1969) and Eliasen, Machenauer, and Rasmussen (1970) developed the transform methods that still form the backbone of many large-scale spectral computations. The original proselytes of spectral methods were meteorologists involved in global weather modeling and fluid dynamicists investigating isotropic turbulence. The converts who were inspired by the successes of these pioneers remained, for the most part, confined to these and closely related fields throughout the 1970's. During that decade spectral methods appeared to be well-suited only for problems governed by ordinary diSerential eqllations or by partial differential equations with periodic boundary conditions. And, of course, the solution itself needed to be smooth. Some of the obstacles to wider application of spectral methods were: (1) poor resolution of discontinuous solutions; (2) inefficient implementation of implicit methods; and (3) drastic geometric constraints. All of these barriers have undergone some erosion during the 1980's, particularly the latter two. As a result, the applicability and appeal of spectral methods for computational fluid dynamics has broadened considerably. The motivation for the use of spectral methods in numerical calculations stems from the attractive approximation properties of orthogonal polynomial expansions.

Zang, T. A.↗

NASA NTRS1974

Computational procedures for mixed equations with shock waves

This paper discusses the procedures we have developed to treat a canonical problem involving a mixed nonlinear equation with boundary data that imply a discontinuous solution. This equation arises in various physical contexts and is basic to the description of the nonlinear acoustic behavior of a shock wave near a caustic. The numerical scheme developed is of second order, treats discontinuities as such by applying the appropriate jump conditions across them, and eliminates the numerical dissipation and dispersion associated with large gradients. Our results are compared with the results of a first-order scheme and with those of a second-order scheme we have developed. The algorithm used here can easily be generalized to more complicated problems, including transonic flows with imbedded shocks.

Yu, N. J.↗

NASA NTRS1984

Metric-discontinuous zonal grid calculations using the Osher scheme

Computations on zonal grids - in particular, grids with metric discontinuities resulting from the interspersion of highly clustered regions with coarse regions - are possible using a fully conservative form of the Osher upwind scheme. These zonal grids can result from an abrupt clustering of points near solution discontinuities or near other flow features that require improved resolution. The zonal approach is shown to capture shocks with almost 'shock-fitting' quality but with minimal effort. Results for inviscid flow, including quasi-one-dimensional nozzle flow, supersonic flow over a cylinder, and blast-wave diffraction by a ramp, are presented. These calculations demonstrate the powerful capabilities of the Osher scheme used in conjunction with zonal grids in simulating flow fields with complex shock patterns.

Rai, M. M.↗

DOE OSTI2024

Physics-informed neural networks for heterogeneous poroelastic media

This study presents a novel physics-informed neural network (PINN) framework for modeling poroelasticity in heterogeneous media with material interfaces. The approach introduces a composite neural network (CoNN) where separate neural networks predict displacement and pressure variables for each material. While sharing identical activation functions, these networks are independently trained for all other parameters. To address challenges posed by heterogeneous material interfaces, the CoNN is integrated with the Interface-PINNs (I-PINNs) framework (Sarma et al., Comput. Methods Appl. Mech. Eng. 429: 117135, 2024), allowing different activation functions across material interfaces. Further, this ensures accurate approximation of discontinuous solution fields and gradients. Performance and accuracy of this combined architecture were evaluated against the conventional PINNs approach, a single neural network (SNN) architecture, and the eXtended PINNs (XPINNs) framework through two one-dimensional benchmark examples with discontinuous material properties. The results show that the proposed CoNN with I-PINNs architecture achieves an RMSE that is two orders of magnitude better than the conventional PINNs approach and is at least 40 times faster than the SNN framework. Compared to XPINNs, the proposed method achieves an RMSE at least one order of magnitude better and is 40% faster.

42 ENGINEERING↗

NASA NTRS1995

Coronal roots of solar wind streams: 3-D MHD modeling

Weak (discontinuous) solutions of the 3-D MHD equations look like a promising tool to model the transonic solar wind with structural elements: current sheets, coronal plumes etc. Using the observational information about various coronal emissions one can include these structural elements into the 3-D MHD solar wind model by embedding the discontinuities of given type. Such 3-D MHD structured solar wind is calculated self-consistently: variants are examined via numerical experiments. In particular, the behavior of coronal plumes in the transonic solar wind flow, is modeled. The input information for numerical modeling (for example, the magnetic field map at the very base of the solar corona) can be adjusted so that fast stream arises over the center of the coronal hole, over the coronal hole boundaries and, even, over the region with closed magnetic topology. 3-D MHD equations have the analytical solution which can serve as a model of supersonic trans-alfvenic solar wind in the (5-20) solar radii heliocentric distance interval. The transverse, nonradial total (gas + magnetic field) pressure balance in the flow is the corner-stone of this solution. The solution describes the filamentation (ray-like structure of the solar corona) and streaming (formation of high-speed streams with velocities up to 800 km/sec) as a consequence of the magnetic field spatial inhomogeneous structure and trans-alfvenic character of the flow. The magnetic field works in the model as a 'controller' for the solar wind streaming and filamentation.

Pisanko, Yu. V.↗

NASA NTRS2011

Discretely Conservative Finite-Difference Formulations for Nonlinear Conservation Laws in Split Form: Theory and Boundary Conditions

Simulations of nonlinear conservation laws that admit discontinuous solutions are typically restricted to discretizations of equations that are explicitly written in divergence form. This restriction is, however, unnecessary. Herein, linear combinations of divergence and product rule forms that have been discretized using diagonal-norm skew-symmetric summation-by-parts (SBP) operators, are shown to satisfy the sufficient conditions of the Lax-Wendroff theorem and thus are appropriate for simulations of discontinuous physical phenomena. Furthermore, special treatments are not required at the points that are near physical boundaries (i.e., discrete conservation is achieved throughout the entire computational domain, including the boundaries). Examples are presented of a fourth-order, SBP finite-difference operator with second-order boundary closures. Sixth- and eighth-order constructions are derived, and included in E. Narrow-stencil difference operators for linear viscous terms are also derived; these guarantee the conservative form of the combined operator.

Fisher, Travis C.↗

NASA NTRS1985

Shock capturing

Recent developments which have improved the understanding of how finite difference methods resolve discontinuous solutions to hyperbolic partial differential equations are discussed. As a result of this understanding improved shock capturing methods are currently being developed and tested. Some of these methods are described and numerical results are presented showing their performance on problems containing shocks in one and two dimensions. A conservative difference scheme is defined. Conservation implies that, except in very special circumstances, shocks must be spread over at least two grid intervals. These two interval shocks are actually attained in one dimension if the shock is steady and an upwind scheme is used. By analyzing this case, the reason for this excellent shock resolution can be determined. This result is used to provide a mechanism for improving the resolution of two dimensional steady shocks. Unfortunately, this same analysis shows that these results cannot be extended to shocks which move relative to the computing grid. Total variation diminishing (TVD) finite difference schemes and flux limiters are introduced to deal with money shocks and contact discontinuities.

Davis, S. F.↗

DOE OSTI2025

Adaptive Interface-PINNs (AdaI-PINNs) for transient diffusion: Applications to forward and inverse problems in heterogeneous media

We model transient diffusion in heterogeneous materials using a novel physics-informed neural networks framework (PINNs) termed Adaptive interface physics-informed neural networks or AdaI-PINNs (Roy et al. arXiv preprint arXiv:2406.04626, 2024). AdaI-PINNs utilize different activation functions with trainable slopes tailored to each material region within the computational domain, allowing for a fully automated and adaptive PINNs approach to model interface problems with strongly and weakly discontinuous solutions. To enhance its performance in highly heterogeneous transient diffusion systems, we prescribe a suite of robust practices, including appropriate non-dimensionalization of equations, a biased sampling method, Glorot initialization, and the hard enforcement of boundary and initial conditions. Here we evaluate the efficacy of the proposed method on several benchmark forward and inverse problems. Comparative studies on one-dimensional and two-dimensional benchmark problems reveal that the modified AdaI-PINNs outperform its unmodified counterpart, achieving root-mean-square errors that are at least two orders of magnitude better in forward problems. For inverse problems, the maximum errors in the approximated diffusion coefficients by modified AdaI-PINNs are four orders of magnitude better than those of the unmodified version. Additionally, modified AdaI-PINNs demonstrate improved stability in problems with large material mismatches.

42 ENGINEERING↗

NASA NTRS1983

Spectral methods for inviscid, compressible flows

Report developments in the application of spectral methods to two dimensional compressible flows are reviewed. A brief introduction to spectral methods -- their history and especially their implementation -- is provided. The stress is on those techniques relevant to transonic flow computation. The spectral multigrid iterative methods are discussed with application to the transonic full potential equation. Discontinuous solutions of the Euler equations are considered. The key element is the shock fitting technique which is briefly explained.

Hussaini, M. Y.↗

NASA NTRS1985

Spectral methods for inviscid, compressible flows

Report developments in the application of spectral methods to two dimensional compressible flows are reviewed. A brief introduction to spectral methods - their history and especially their implementation - is provided. The stress is on those techniques relevant to transonic flow computation. The spectral multigrid iterative methods are discussed with application to the transonic full potential equation. Discontinuous solutions of the Euler equations are considered. The key element is the shock fitting technique which is briefly explained.

Hussaini, M. Y.↗

NASA NTRS1987

Efficient implementation of essentially non-oscillatory shock capturing schemes

In the computation of discontinuous solutions of hyperbolic conservation laws, TVD (total-variation-diminishing), TVB (total-variation-bounded) and the recently developed ENO (essentially non-oscillatory) schemes have proven to be very useful. In this paper two improvements are discussed: a simple TVD Runge-Kutta type time discretization, and an ENO construction procedure based on fluxes rather than on cell averages. These improvements simplify the schemes considerably -- especially for multi-dimensional problems or problems with forcing terms. Preliminary numerical results are also given.

Shu, Chi-Wang↗

NASA NTRS1988

Efficient implementation of essentially non-oscillatory shock-capturing schemes

In the computation of discontinuous solutions of hyperbolic conservation laws, TVD (total-variation-diminishing), TVB (total-variation-bounded) and the recently developed ENO (essentially non-oscillatory) schemes have proven to be very useful. In this paper two improvements are discussed: a simple TVD Runge-Kutta type time discretization, and an ENO construction procedure based on fluxes rather than on cell averages. These improvements simplify the schemes considerably - especially for multi-dimensional problems or problems with forcing terms. Preliminary numerical results are also given.

Shu, Chi-Wang↗

NASA NTRS1989

Nonlinear filters for efficient shock computation

A new type of methods for the numerical approximation of hyperbolic conservation laws with discontinuous solution is introduced. The methods are based on standard finite difference schemes. The difference solution is processed with a nonlinear conservation form filter at every time level to eliminate spurious oscillations near shocks. It is proved that the filter can control the total variation of the solution and also produce sharp discrete shocks. The method is simpler and faster than many other high resolution schemes for shock calculations. Numerical examples in one and two space dimensions are presented.

Engquist, Bjorn↗

NASA NTRS1990

High order filtering methods for approximating hyberbolic systems of conservation laws

In the computation of discontinuous solutions of hyperbolic systems of conservation laws, the recently developed essentially non-oscillatory (ENO) schemes appear to be very useful. However, they are computationally costly compared to simple central difference methods. A filtering method which is developed uses simple central differencing of arbitrarily high order accuracy, except when a novel local test indicates the development of spurious oscillations. At these points, the full ENO apparatus is used, maintaining the high order of accuracy, but removing spurious oscillations. Numerical results indicate the success of the method. High order of accuracy was obtained in regions of smooth flow without spurious oscillations for a wide range of problems and a significant speed up of generally a factor of almost three over the full ENO method.

Lafon, F.↗

NASA NTRS1991

High order filtering methods for approximating hyperbolic systems of conservation laws

The essentially nonoscillatory (ENO) schemes, while potentially useful in the computation of discontinuous solutions of hyperbolic conservation-law systems, are computationally costly relative to simple central-difference methods. A filtering technique is presented which employs central differencing of arbitrarily high-order accuracy except where a local test detects the presence of spurious oscillations and calls upon the full ENO apparatus to remove them. A factor-of-three speedup is thus obtained over the full-ENO method for a wide range of problems, with high-order accuracy in regions of smooth flow.

Lafon, F.↗

NASA NTRS1991

The Development of High Order Numerical Techniques for Reentry Simulation of Hypersonic Spacecraft

The primary difficulty encountered when simulating hypersonic flow is that the flow normally includes strong nonlinear discontinuities. These discontinuities fall into three broad classes: shocks, slip-lines, and rarefaction waves. Moreover, in the hypersonic flow regime, the chemistry of hot gases plays a vital role and can not be neglected. These facts combine to make the numerical treatment of spacecraft reentry a most challenging problem. In this work, we develop a class of finite difference schemes that accurately resolve discontinuous solutions to spacecraft reentry flow and are simple to incorporate into existing spacecraft reentry codes.

Sanders, Richard↗

NASA NTRS2002

Corrections for Convective Heat Flux Gauges Subjected to a Surface Temperature Discontinuity

A two-dimensional Navier-Stokes computational fluid dynamics (CFD) analysis has been carried out in an effort to determine the convective heat transfer corrections for circular heat flux gauges subjected to a surface temperature discontinuity. Solutions were obtained at a Reynolds number Of 1 x 10(exp 6) and a Mach number of 4. The CFD results are compared with the existing correlations for the correction factors. In general, the CFD corrections exceed those provided by the correlations. The discrepancy increases with increasing upstream surface temperature, thus indicating the role of property variations, which are not accounted for in the correlations. A quasi-two-dimensional analysis is also performed to treat the cylindrical geometry of the heat flux gauges by area-averaging the computed two-dimensional results from CFD.

Kandula, M.↗

NASA NTRS2009

Boundary Closures for Fourth-order Energy Stable Weighted Essentially Non-Oscillatory Finite Difference Schemes

A general strategy exists for constructing Energy Stable Weighted Essentially Non Oscillatory (ESWENO) finite difference schemes up to eighth-order on periodic domains. These ESWENO schemes satisfy an energy norm stability proof for both continuous and discontinuous solutions of systems of linear hyperbolic equations. Herein, boundary closures are developed for the fourth-order ESWENO scheme that maintain wherever possible the WENO stencil biasing properties, while satisfying the summation-by-parts (SBP) operator convention, thereby ensuring stability in an L2 norm. Second-order, and third-order boundary closures are developed that achieve stability in diagonal and block norms, respectively. The global accuracy for the second-order closures is three, and for the third-order closures is four. A novel set of non-uniform flux interpolation points is necessary near the boundaries to simultaneously achieve 1) accuracy, 2) the SBP convention, and 3) WENO stencil biasing mechanics.

Fisher, Travis C.↗