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NASA NTRS1998

Globalized Newton-Krylov-Schwarz Algorithms and Software for Parallel Implicit CFD

Implicit solution methods are important in applications modeled by PDEs with disparate temporal and spatial scales. Because such applications require high resolution with reasonable turnaround, "routine" parallelization is essential. The pseudo-transient matrix-free Newton-Krylov-Schwarz (Psi-NKS) algorithmic framework is presented as an answer. We show that, for the classical problem of three-dimensional transonic Euler flow about an M6 wing, Psi-NKS can simultaneously deliver: globalized, asymptotically rapid convergence through adaptive pseudo- transient continuation and Newton's method-, reasonable parallelizability for an implicit method through deferred synchronization and favorable communication-to-computation scaling in the Krylov linear solver; and high per- processor performance through attention to distributed memory and cache locality, especially through the Schwarz preconditioner. Two discouraging features of Psi-NKS methods are their sensitivity to the coding of the underlying PDE discretization and the large number of parameters that must be selected to govern convergence. We therefore distill several recommendations from our experience and from our reading of the literature on various algorithmic components of Psi-NKS, and we describe a freely available, MPI-based portable parallel software implementation of the solver employed here.

Gropp, W. D.↗

NASA NTRS1994

Parallel Preconditioning for CFD Problems on the CM-5

Up to today, preconditioning methods on massively parallel systems have faced a major difficulty. The most successful preconditioning methods in terms of accelerating the convergence of the iterative solver such as incomplete LU factorizations are notoriously difficult to implement on parallel machines for two reasons: (1) the actual computation of the preconditioner is not very floating-point intensive, but requires a large amount of unstructured communication, and (2) the application of the preconditioning matrix in the iteration phase (i.e. triangular solves) are difficult to parallelize because of the recursive nature of the computation. Here we present a new approach to preconditioning for very large, sparse, unsymmetric, linear systems, which avoids both difficulties. We explicitly compute an approximate inverse to our original matrix. This new preconditioning matrix can be applied most efficiently for iterative methods on massively parallel machines, since the preconditioning phase involves only a matrix-vector multiplication, with possibly a dense matrix. Furthermore the actual computation of the preconditioning matrix has natural parallelism. For a problem of size n, the preconditioning matrix can be computed by solving n independent small least squares problems. The algorithm and its implementation on the Connection Machine CM-5 are discussed in detail and supported by extensive timings obtained from real problem data.

Simon, Horst D.↗

NASA NTRS1995

A Hybrid Parallel Preconditioning Algorithm For CFD

A new hybrid preconditioning algorithm will be presented which combines the favorable attributes of incomplete lower-upper (ILU) factorization with the favorable attributes of the approximate inverse method recently advocated by numerous researchers. The quality of the preconditioner is adjustable and can be increased at the cost of additional computation while at the same time the storage required is roughly constant and approximately equal to the storage required for the original matrix. In addition, the preconditioning algorithm suggests an efficient and natural parallel implementation with reduced communication. Sample calculations will be presented for the numerical solution of multi-dimensional advection-diffusion equations. The matrix solver has also been embedded into a Newton algorithm for solving the nonlinear Euler and Navier-Stokes equations governing compressible flow. The full paper will show numerous examples in CFD to demonstrate the efficiency and robustness of the method.

Barth,Timothy J.↗

NASA NTRS1998

Algebraic Nonoverlapping Domain Decomposition Methods for Stabilized FEM and FV Discretizations

We consider preconditioning methods for convection dominated fluid flow problems based on a nonoverlapping Schur complement domain decomposition procedure for arbitrary triangulated domains. The triangulation is first partitioned into a number of subdomains and interfaces which induce a natural 2 x 2 partitioning of the p.d.e. discretization matrix. We view the Schur complement induced by this partitioning as an algebraically derived coarse space approximation. This avoids the known difficulties associated with the direct formation of an effective coarse discretization for advection dominated equations. By considering various approximations of the block factorization of the 2 x 2 system, we have developed a family of robust preconditioning techniques. A computer code based on these ideas has been developed and tested on the IBM SP2 using MPI message passing protocol. A number of 2-D CFD calculations will be presented for both scalar advection-diffusion equations and the Euler equations discretized using stabilized finite element and finite volume methods. These results show very good scalability of the preconditioner for various discretizations as the number of processors is increased while the number of degrees of freedom per processor is fixed.

Barth, Timothy J.↗

NASA NTRS2003

Some Remarks on GMRES for Transport Theory

We review some work on the application of GMRES to the solution of the discrete ordinates transport equation in one-dimension. We note that GMRES can be applied directly to the angular flux vector, or it can be applied to only a vector of flux moments as needed to compute the scattering operator of the transport equation. In the former case we illustrate both the delights and defects of ILU right-preconditioners for problems with anisotropic scatter and for problems with upscatter. When working with flux moments we note that GMRES can be used as an accelerator for any existing transport code whose solver is based on a stationary fixed-point iteration, including transport sweeps and DSA transport sweeps. We also provide some numerical illustrations of this idea. We finally show how space can be traded for speed by taking multiple transport sweeps per GMRES iteration. Key Words: transport equation, GMRES, Krylov subspace

Patton, Bruce W.↗

NASA NTRS2003

A Study of the Impact of Variations on Aerodynamic Flow in Gas Turbine Engines via Monte-Carlo Simulations

The unsteady compressible inviscid flow is characterized by the conservations of mass, momentum, and energy; or simply the Euler equations. In this paper, a study of the subsonic one-dimensional Euler equations with local preconditioning is presented with a modal analysis approach. Specifically, this study investigates the behavior of airflow in a gas turbine engine using the specified conditions at the inflow and outflow boundaries of the compressor, combustion chamber, and turbine, under the impact of variations in pressure, velocity, temperature, and density at low Mach numbers. Two main questions that motivate this research are: 1) Is there any aerodynamic problem with the existing gas turbine engines that could impact aircraft performance? 2) If yes, what aspect of a gas turbine engine could be improved via design to alleviate that impact and to optimize aircraft performance. This paper presents an initial attempt to the flow behavior in terms (perturbation) using simulation outputs from a customer-deck model obtained from Pratt&Whitney, (i.e., pressure, temperature, velocity, density) about their mean states at the inflow and outflow boundaries of the compressor, combustion chamber, and turbine. Flow behavior is analyzed for the high pressure compressor and combustion chamber employing the conditions on their left and right boundaries. In the same fashion, similar analyses are carried out for the high and low-pressure turbines. In each case, the eigenfrequencies that are obtained for different boundary conditions are examined closely based on their probabilistic distributions, a result of a Monte Carlo 10,000-sample simulation. Furthermore, the characteristic waves and eave response are analyzed and contrasted among different cases, with and without preconditioners. The results reveal the existence of flow instabilities due to the combined effect of variations and excessive pressures; which are clearly the case in the combustion chamber and high-pressure turbine. Finally a discussion is presented on potential impacts of the instabilities and what can be improved via design to alleviate them for a better aircraft performance.

Ngo, Khiem Viet↗

NASA NTRS2004

Impact of Variations on 1-D Flow in Gas Turbine Engines via Monte Carlo Simulations

The unsteady compressible inviscid flow is characterized by the conservations of mass, momentum, and energy; or simply the Euler equations. In this paper, a study of the subsonic one-dimensional Euler equations with local preconditioning is presented using a modal analysis approach. Specifically, this study investigates the behavior of airflow in a gas turbine engine using the specified conditions at the inflow and outflow boundaries of the compressor, combustion chamber, and turbine, to determine the impact of variations in pressure, velocity, temperature, and density at low Mach numbers. Two main questions motivate this research: 1) Is there any aerodynamic problem with the existing gas turbine engines that could impact aircraft performance? 2) If yes, what aspect of a gas turbine engine could be improved via design to alleviate that impact and to optimize aircraft performance? This paper presents an initial attempt to model the flow behavior in terms of their eigenfrequencies subject to the assumption of the uncertainty or variation (perturbation). The flow behavior is explored using simulation outputs from a customer-deck model obtained from Pratt & Whitney. Variations of the main variables (i.e., pressure, temperature, velocity, density) about their mean states at the inflow and outflow boundaries of the compressor, combustion chamber, and turbine are modeled. Flow behavior is analyzed for the high-pressure compressor and combustion chamber utilizing the conditions on their left and right boundaries. In the same fashion, similar analyses are carried out for the high-pressure and low-pressure turbines. In each case, the eigenfrequencies that are obtained for different boundary conditions are examined closely based on their probabilistic distributions, a result of a Monte Carlo 10,000 sample simulation. Furthermore, the characteristic waves and wave response are analyzed and contrasted among different cases, with and without preconditioners. The results reveal the existence of flow instabilities due to the combined effect of variations and excessive pressures in the case of the combustion chamber and high-pressure turbine. Finally, a discussion is presented on potential impacts of the instabilities and what can be improved via design to alleviate them for a better aircraft performance.

Ngo, Khiem Viet↗

NASA NTRS2006

Convergence Acceleration for Multistage Time-Stepping Schemes

The convergence of a Runge-Kutta (RK) scheme with multigrid is accelerated by preconditioning with a fully implicit operator. With the extended stability of the Runge-Kutta scheme, CFL numbers as high as 1000 could be used. The implicit preconditioner addresses the stiffness in the discrete equations associated with stretched meshes. Numerical dissipation operators (based on the Roe scheme, a matrix formulation, and the CUSP scheme) as well as the number of RK stages are considered in evaluating the RK/implicit scheme. Both the numerical and computational efficiency of the scheme with the different dissipation operators are discussed. The RK/implicit scheme is used to solve the two-dimensional (2-D) and three-dimensional (3-D) compressible, Reynolds-averaged Navier-Stokes equations. In two dimensions, turbulent flows over an airfoil at subsonic and transonic conditions are computed. The effects of mesh cell aspect ratio on convergence are investigated for Reynolds numbers between 5.7 x 10(exp 6) and 100.0 x 10(exp 6). Results are also obtained for a transonic wing flow. For both 2-D and 3-D problems, the computational time of a well-tuned standard RK scheme is reduced at least a factor of four.

Swanson, R. C.↗

NASA NTRS2008

An Initial Investigation of the Effects of Turbulence Models on the Convergence of the RK/Implicit Scheme

A three-stage Runge-Kutta (RK) scheme with multigrid and an implicit preconditioner has been shown to be an effective solver for the fluid dynamic equations. This scheme has been applied to both the compressible and essentially incompressible Reynolds-averaged Navier-Stokes (RANS) equations using the algebraic turbulence model of Baldwin and Lomax (BL). In this paper we focus on the convergence of the RK/implicit scheme when the effects of turbulence are represented by either the Spalart-Allmaras model or the Wilcox k-! model, which are frequently used models in practical fluid dynamic applications. Convergence behavior of the scheme with these turbulence models and the BL model are directly compared. For this initial investigation we solve the flow equations and the partial differential equations of the turbulence models indirectly coupled. With this approach we examine the convergence behavior of each system. Both point and line symmetric Gauss-Seidel are considered for approximating the inverse of the implicit operator of the flow solver. To solve the turbulence equations we use a diagonally dominant alternating direction implicit (DDADI) scheme. Computational results are presented for three airfoil flow cases and comparisons are made with experimental data. We demonstrate that the two-dimensional RANS equations and transport-type equations for turbulence modeling can be efficiently solved with an indirectly coupled algorithm that uses the RK/implicit scheme for the flow equations.

Swanson, R. C.↗

NASA NTRS2002

Higher Order Bases in a 2D Hybrid BEM/FEM Formulation

The advantages of using higher order, interpolatory basis functions are examined in the analysis of transverse electric (TE) plane wave scattering by homogeneous, dielectric cylinders. A boundary-element/finite-element (BEM/FEM) hybrid formulation is employed in which the interior dielectric region is modeled with the vector Helmholtz equation, and a radiation boundary condition is supplied by an Electric Field Integral Equation (EFIE). An efficient method of handling the singular self-term arising in the EFIE is presented. The iterative solution of the partially dense system of equations is obtained using the Quasi-Minimal Residual (QMR) algorithm with an Incomplete LU Threshold (ILUT) preconditioner. Numerical results are shown for the case of an incident wave impinging upon a square dielectric cylinder. The convergence of the solution is shown versus the number of unknowns as a function of the completeness order of the basis functions.

Fink, Patrick W.↗

NASA NTRS2013

Design of a Variational Multiscale Method for Turbulent Compressible Flows

A spectral-element framework is presented for the simulation of subsonic compressible high-Reynolds-number flows. The focus of the work is maximizing the efficiency of the computational schemes to enable unsteady simulations with a large number of spatial and temporal degrees of freedom. A collocation scheme is combined with optimized computational kernels to provide a residual evaluation with computational cost independent of order of accuracy up to 16th order. The optimized residual routines are used to develop a low-memory implicit scheme based on a matrix-free Newton-Krylov method. A preconditioner based on the finite-difference diagonalized ADI scheme is developed which maintains the low memory of the matrix-free implicit solver, while providing improved convergence properties. Emphasis on low memory usage throughout the solver development is leveraged to implement a coupled space-time DG solver which may offer further efficiency gains through adaptivity in both space and time.

Design↗

NASA NTRS2015

Improved Convergence and Robustness of USM3D Solutions on Mixed Element Grids (Invited)

Several improvements to the mixed-element USM3D discretization and defect-correction schemes have been made. A new methodology for nonlinear iterations, called the Hierarchical Adaptive Nonlinear Iteration Scheme (HANIS), has been developed and implemented. It provides two additional hierarchies around a simple and approximate preconditioner of USM3D. The hierarchies are a matrix-free linear solver for the exact linearization of Reynolds-averaged Navier Stokes (RANS) equations and a nonlinear control of the solution update. Two variants of the new methodology are assessed on four benchmark cases, namely, a zero-pressure gradient flat plate, a bump-in-channel configuration, the NACA 0012 airfoil, and a NASA Common Research Model configuration. The new methodology provides a convergence acceleration factor of 1.4 to 13 over the baseline solver technology.

Pandya, Mohagna J.↗

NASA NTRSDate not supplied

Efficient Preconditioning of a High-Order Solver for Multiple Physics

This work addresses preconditioning approaches for an implicit high-order solver frame-work applied to multiple physics. The solver is based on a space-time spectral element method and matrix-free Newton-Krylov solver developed at NASA over the recent years. Within this context, most preconditioning methods are impractical, as the computational time and memory requirements scale poorly with increasing polynomial orders. To improve computational efficiency, we first describe a novel entity-based Block Jacobi preconditioner for the continuous-Galerkin solution of the linear-elasticity and linear-shell equations. Second, we introduce a multigrid algorithm to further reduce time-to-solution on stiff cases arising from continuous-and discontinuous-Galerkin discretizations. Results obtained on relevant single-physics reference solutions, demonstrate the feasibility of the methods, paving the way for high-order solutions of fully coupled multi-physics problems.

STMD↗

NASA NTRSDate not supplied

Nonlinear Nonmodal Analysis of Hypersonic Flow over Blunt Cones

The linear amplification of modal disturbances that lead to boundary-layer transition in two-dimensional/axisymmetric hypersonic configurations is strongly reduced by the presence of a blunt nosetip, and the mechanisms underlying the observed onset of transition over the cone frustum are currently unknown. Linear nonmodal analysis has shown that both planar and oblique traveling disturbances that peak within the entropy layer experience appreciable energy amplification for moderate to large nosetip bluntness. The present study extends the previous linear analysis by including the nonlinear effects. Specifically, the perturbation form of the 2D, harmonic Navier-Stokes equations (HNSE) are solved with a fully implicit formulation and the Newton-Raphson method. The increased number of degrees of freedom for the nonlinear system presents difficulties for solution strategies based on direct solution of the linearized system. Such difficulties are overcome by using the GMRES iterative method with a preconditioner corresponding to a simplified Jacobian without the cross derivative terms. The HNSE solver is verified by comparing with nonlinear parabolized stability equation (NPSE) results for the nonlinear evolution of planar waves in an incompressible Blasius boundary layer and in a Mach 6 flow over a blunt cone. Finally, nonlinear nonmodal results are presented for planar traveling disturbances over the blunt cone. The nonmodal analysis demonstrates that entropy-layer disturbances generated close to the nose tip can seed the amplification of higher frequency Mack’s second-mode instabilities further downstream.

boundary layer transition↗

NASA NTRSDate not supplied

Nonlinear Nonmodal Analysis of Hypersonic Flow over Blunt Cones

boundary layer transition↗

NASA NTRSDate not supplied

Implicit Preconditioning for Explicit Multigrid Solvers on Cut-Cell Cartesian Meshes

This work assesses the effectiveness of linearized implicit Euler preconditioning for multigrid solvers using an unpreconditioned, Jacobian-free Newton Krylov method to converge the linear system of equations. Multigrid convergence rates improve to approximately 0.75 across the cases tested including a Mach 2 supersonic wedge, transonic NACA 0012 airfoil, and ONERA M6 wing. While larger Krylov subspaces increase the convergence rate, they also increase the computational cost, such that 4-8 Krylov vectors often offers the fastest turnaround. Further reductions in computational cost are achieved with a sequential hybrid preconditioner that begins with the explicit multigrid solver before transitioning to the preconditioned algorithm later on. In addition, a novel implementation of dual time stepping is extended to include both common BDF methods as well as high-order implicit Runge-Kutta schemes. This particular formulation, which uses A −1 preconditioning, is amenable to matrix-free solvers, and the L-stable methods are especially suited for meshes with arbitrarily small cut-cells. Asymptotic order of convergence is demonstrated for BDF1, BDF2, SDIRK2, and 3rd-order Radau IIA time integration with unsteady 2D vortex simulations.

ARMD↗

DOE OSTI2022

Neumann Series in MGS-GMRES and Inner-Outer Iterations: Preprint

A low-synchronization MGS-GMRES Krylov solver employing a truncated Neumann series for the inverse compact WY MGS correction matrix T is presented. A corollary to the backward stability result of Paige et al. [1] establishes that T = I - Lk is sufficient for convergence of GMRES when kLkp F = O("p)_p F (B), where the strictly lower triangular matrix L is defined by the inner products of Krylov vectors V T 1:k-2 vk-1. The preconditioner is the classical Ruge-Stuben AMG algorithm with compatible relaxation and inner-outer Gauss-Seidel smoother. This smoother may also be expressed as a truncated Neumann series. Drop tolerances are applied to the lower triangular matrices arising in the smoother in order to reduce the number of non-zeros and accelerate the time to solution. The number of small matrix elements are found to increase from fine to coarse levels and thus the effciency gains are greater for large problems with many levels in the V -cycle. The solver is applied to the pressure continuity equation for the incompressible Navier-Stokes equations. Unlike the inner-outer iteration, the solver convergence rate with the standard Gauss-Seidel smoother deteriorates with dropping. The solver compute time is reduced by up to 50% without a change in the convergence rate.

Gauss-Seidel smoother↗

DOE OSTI2023

Exascale Multiphysics Nuclear Reactor Simulations for Advanced Designs

ENRICO is a coupled application developed under the U.S. Department of Energy's Exascale Computing Project (ECP) targeting the modeling of advanced nuclear reactors. It couples radiation transport with heat and fluid simulation, including the high-fidelity, highresolution Monte-Carlo code Shift and the Computational fluid dynamics code NekRS. NekRS is a highly-performant open-source code for simulation of incompressible and low-Mach fluid flow, heat transfer, and combustion with a particular focus on turbulent flows in complex domains. It is based on rapidly convergent high-order spectral element discretizations that feature minimal numerical dissipation and dispersion. State-of-the-art multilevel preconditioners, efficient high-order time-splitting methods, and runtime-adaptive communication strategies are built on a fast OCCA-based kernel library, libParanumal, to provide scalability and portability across the spectrum of current and future high-performance computing platforms. On Frontier, Nek5000/RS has recently achieved an unprecedented milestone in breaching over 1 billion spectral elements and 350 billion degrees of freedom. Shift has demonstrated the capability to transport upwards of 1 billion particles per second in full core nuclear reactor simulations featuring complete temperature-dependent, continuous-energy physics on Frontier. Shift achieved a weak-scaling efficiency of 97.8% on 8192 nodes of Frontier and calculated 6 reactions in 214,896 fuel pin regions below 1% statistical error yielding first-of-a-kind resolution for a Monte Carlo transport application.

Hamilton, Steven P.↗