A FEAST algorithm with oblique projection for generalized eigenvalue problems

The contour integral‐based eigensolvers are the recent efforts for computing the eigenvalues inside a given region in the complex plane. The best‐known members are the Sakurai–Sugiura method, its stable version CIRR, and the FEAST algorithm. An attractive computational advantage of these methods is that they are easily parallelizable. The FEAST algorithm was developed for the generalized Hermitian eigenvalue problems. It is stable and accurate. However, it may fail when applied to non‐Hermitian problems. Recently, a dual subspace FEAST algorithm was proposed to extend the FEAST algorithm to non‐Hermitian problems. In this paper, we instead use the oblique projection technique to extend FEAST to the non‐Hermitian problems. Our approach can be summarized as follows: (a) construct a particular contour integral to form a search subspace containing the desired eigenspace and (b) use the oblique projection technique to extract desired eigenpairs with appropriately chosen test subspace. The related mathematical framework is established. Comparing to the dual subspace FEAST algorithm, we can save the computational cost roughly by a half if only the eigenvalues or the eigenvalues together with their right eigenvectors are needed. We also address some implementation issues such as how to choose a suitable starting matrix and design‐efficient stopping criteria. Numerical experiments are provided to illustrate that our method is stable and efficient.     

On a type of matrix splitting preconditioners for a class of block two-by-two linear systems

Recently, Bai et al. (2013) proposed an effective and efficient matrix splitting iterative method, called preconditioned modified Hermitian/skew-Hermitian splitting (PMHSS) iteration method, for two-by-two block linear systems of equations. The eigenvalue distribution of the iterative matrix suggests that the splitting matrix could be advantageously used as a preconditioner. In this study, the CGNR method is utilized for solving the PMHSS preconditioned linear systems, and the performance of the method is considered by estimating the condition number of the normal equations. Furthermore, the proposed method is compared with other PMHSS preconditioned Krylov subspace methods by solving linear systems arising in complex partial differential equations and a distributed control problem. The numerical results demonstrate the difference in the performance of the methods under consideration.     

Fast inexact subspace iteration for generalized eigenvalue problems with spectral transformation

We study inexact subspace iteration for solving generalized non-Hermitian eigenvalue problems with spectral transformation, with focus on a few strategies that help accelerate preconditioned iterative solution of the linear systems of equations arising in this context. We provide new insights into a special type of preconditioner with “tuning” that has been studied for this algorithm applied to standard eigenvalue problems. Specifically, we propose an alternative way to use the tuned preconditioner to achieve similar performance for generalized problems, and we show that these performance improvements can also be obtained by solving an inexpensive least squares problem. In addition, we show that the cost of iterative solution of the linear systems can be further reduced by using deflation of converged Schur vectors, special starting vectors constructed from previously solved linear systems, and iterative linear solvers with subspace recycling. The effectiveness of these techniques is demonstrated by numerical experiments.     

A block inverse-free preconditioned Krylov subspace method for symmetric generalized eigenvalue problems

The inverse-free preconditioned Krylov subspace method of Golub and Ye [G.H. Golub, Q. Ye, An inverse free preconditioned Krylov subspace method for symmetric generalized eigenvalue problems, SIAM J. Sci. Comp. 24 (2002) 312-334] is an efficient algorithm for computing a few extreme eigenvalues of the symmetric generalized eigenvalue problem. In this paper, we first present an analysis of the preconditioning strategy based on incomplete factorizations. We then extend the method by developing a block generalization for computing multiple or severely clustered eigenvalues and develop a robust black-box implementation. Numerical examples are given to illustrate the analysis and the efficiency of the block algorithm.     

Compress‐and‐restart block Krylov subspace methods for Sylvester matrix equations

Block Krylov subspace methods (KSMs) comprise building blocks in many state‐of‐the‐art solvers for large‐scale matrix equations as they arise, for example, from the discretization of partial differential equations. While extended and rational block Krylov subspace methods provide a major reduction in iteration counts over polynomial block KSMs, they also require reliable solvers for the coefficient matrices, and these solvers are often iterative methods themselves. It is not hard to devise scenarios in which the available memory, and consequently the dimension of the Krylov subspace, is limited. In such scenarios for linear systems and eigenvalue problems, restarting is a well‐explored technique for mitigating memory constraints. In this work, such restarting techniques are applied to polynomial KSMs for matrix equations with a compression step to control the growing rank of the residual. An error analysis is also performed, leading to heuristics for dynamically adjusting the basis size in each restart cycle. A panel of numerical experiments demonstrates the effectiveness of the new method with respect to extended block KSMs.     

Convergence estimates of nonrestarted and restarted block‐Lanczos methods

The block‐Lanczos method serves to compute a moderate number of eigenvalues and the corresponding invariant subspace of a symmetric matrix. In this paper, the convergence behavior of nonrestarted and restarted versions of the block‐Lanczos method is analyzed. For the nonrestarted version, we improve an estimate by Saad by means of a change of the auxiliary vector so that the new estimate is much more accurate in the case of clustered or multiple eigenvalues. For the restarted version, an estimate by Knyazev is generalized by extending our previous results on block steepest descent iterations and single‐vector restarted Krylov subspace iterations. The new estimates can also be reformulated and applied to invert‐block‐Lanczos methods for solving generalized matrix eigenvalue problems.     

Stein implicit Runge-Kutta methods with high stage order for large-scale ordinary differential equations

The Runge-Kutta method is one of the most popular implicit methods for the solution of stiff ordinary differential equations. For large problems, the main drawback of such methods is the cost required at each integration step for computing the solution of a nonlinear system of equations. In this paper, we propose to reduce the cost of the computation by transforming the linear systems arising in the application of Newton's method to Stein matrix equations. We propose an iterative projection method onto block Krylov subspaces for solving numerically such Stein matrix equations. Numerical examples are given to illustrate the performance of our proposed method.     

Restarted FOM Augmented with Ritz Vectors for Shifted Linear Systems

The restarted FOM method presented by Simoncini[7]according to the natural collinearity of all residuals is an efficient method for solving shifted systems,which generates the same Krylov subspace when the shifts are handled simultaneously.However,restarting slows down the convergence.We present a practical method for solving the shifted systems by adding some Ritz vectors into the Krylov subspace to form an augmented Krylov subspace. Numerical experiments illustrate that the augmented FOM approach(restarted version)can converge more quickly than the restarted FOM method.     

A block Arnoldi-type contour integral spectral projection method for solving generalized eigenvalue problems

For generalized eigenvalue problems, we consider computing all eigenvalues located in a certain region and their corresponding eigenvectors. Recently, contour integral spectral projection methods have been proposed for solving such problems. In this study, from the analysis of the relationship between the contour integral spectral projection and the Krylov subspace, we conclude that the Rayleigh–Ritz-type of the contour integral spectral projection method is mathematically equivalent to the Arnoldi method with the projected vectors obtained from the contour integration. By this Arnoldi-based interpretation, we then propose a block Arnoldi-type contour integral spectral projection method for solving the eigenvalue problem.     

A block GMRES method with deflated restarting for solving linear systems with multiple shifts and multiple right‐hand sides

The restarted block generalized minimum residual method (BGMRES) with deflated restarting (BGMRES‐DR) was proposed by Morgan to dump the negative effect of small eigenvalues from the convergence of the BGMRES method. More recently, Wu et al. introduced the shifted BGMRES method (BGMRES‐Sh) for solving the sequence of linear systems with multiple shifts and multiple right‐hand sides. In this paper, a new shifted block Krylov subspace algorithm that combines the characteristics of both the BGMRES‐DR and the BGMRES‐Sh methods is proposed. Moreover, our method is enhanced with a seed selection strategy to handle the case of almost linear dependence of the right‐hand sides. Numerical experiments illustrate the potential of the proposed method to solve efficiently the sequence of linear systems with multiple shifts and multiple right‐hand sides, with and without preconditioner, also against other state‐of‐the‐art solvers.     

A SHIFT-SPLITTING PRECONDITIONER FOR NON-HERMITIAN POSITIVE DEFINITE MATRICES

A shift splitting concept is introduced and, correspondingly, a shift-splitting iteration scheme and a shift-splitting preconditioner are presented, for solving the large sparse system of linear equations of which the coefficient matrix is an ill-conditioned non-Hermitian positive definite matrix. The convergence property of the shift-splitting iteration method and the eigenvalue distribution of the shift-splitting preconditioned matrix are discussed in depth, and the best possible choice of the shift is investigated in detail. Numerical computations show that the shift-splitting preconditioner can induce accurate, robust and effective preconditioned Krylov subspace iteration methods for solving the large sparse non-Hermitian positive definite systems of linear equations.     

Matrix Krylov subspace methods for linear systems with multiple right-hand sides

In this paper, we first give a result which links any global Krylov method for solving linear systems with several right-hand sides to the corresponding classical Krylov method. Then, we propose a general framework for matrix Krylov subspace methods for linear systems with multiple right-hand sides. Our approach use global projection techniques, it is based on the Global Generalized Hessenberg Process (GGHP) – which use the Frobenius scalar product and construct a basis of a matrix Krylov subspace – and on the use of a Galerkin or a minimizing norm condition. To accelerate the convergence of global methods, we will introduce weighted global methods. In these methods, the GGHP uses a different scalar product at each restart. Experimental results are presented to show the good performances of the weighted global methods. AMS subject classification 65F10     

Krylov子空间投影法及其在油藏数值模拟中的应用

Krylov子空间投影法是一类非常有效的大型线性代数方程组解法,随着左右空间L_m、K_m的不同选取可以得到许多人们熟知的方法.按矩阵H_m的不同类型,将Krylov子空间方法分成两大类,简要分析了这两类方法的优缺点及其最新进展.将目前最为可靠实用的广义最小余量法(GMRES)应用于油藏数值模拟计算问题,利用矩阵分块技术,采用块拟消去法(PE)对系数阵进行预处理.计算结果表明本文的预处理GMRES方法优于目前使用较多的预处理正交极小化ORTHMIN方法,最后还讨论了投影类方法的局限和今后的可能发展方向.     

A deflated conjugate gradient method for multiple right hand sides and multiple shifts

We consider the task of computing solutions of linear systems that only differ by a shift with the identity matrix as well as linear systems with several different right-hand sides. In the past, Krylov subspace methods have been developed which exploit either the need for solutions to multiple right-hand sides (e.g. deflation type methods and block methods) or multiple shifts (e.g. shifted CG) with some success. In this paper we present a block Krylov subspace method which, based on a block Lanczos process, exploits both features—shifts and multiple right-hand sides—at once. Such situations arise, for example, in lattice quantum chromodynamics (QCD) simulations within the Rational Hybrid Monte Carlo (RHMC) algorithm. We present numerical evidence that our method is superior compared to applying other iterative methods to each of the systems individually as well as, in typical situations, to shifted or block Krylov subspace methods.     

Adaptive solution of infinite linear systems by Krylov subspace methods

In this paper we consider the problem of approximating the solution of infinite linear systems, finitely expressed by a sparse coefficient matrix. We analyse an algorithm based on Krylov subspace methods embedded in an adaptive enlargement scheme. The management of the algorithm is not trivial, due to the irregular convergence behaviour frequently displayed by Krylov subspace methods for nonsymmetric systems. Numerical experiments, carried out on several test problems, indicate that the more robust methods, such as GMRES and QMR, embedded in the adaptive enlargement scheme, exhibit good performances.     

A numerical comparison of two minimal residual methods for linear polynomials in unitary matrices

Two minimal residual methods for solving linear systems of the form (αU + βI)x = b, where U is a unitary matrix, are compared numerically. The first method uses conventional Krylov subspaces, while the second involves generalized Krylov subspaces. Experiments favor the second method if |α| > |β|. Moreover, the greater the ratio |α|/|β|, the higher the superiority of the second method.     

Deflated GMRES for systems with multiple shifts and multiple right-hand sides

We consider solution of multiply shifted systems of nonsymmetric linear equations, possibly also with multiple right-hand sides. First, for a single right-hand side, the matrix is shifted by several multiples of the identity. Such problems arise in a number of applications, including lattice quantum chromodynamics where the matrices are complex and non-Hermitian. Some Krylov iterative methods such as GMRES and BiCGStab have been used to solve multiply shifted systems for about the cost of solving just one system. Restarted GMRES can be improved by deflating eigenvalues for matrices that have a few small eigenvalues. We show that a particular deflated method, GMRES-DR, can be applied to multiply shifted systems.In quantum chromodynamics, it is common to have multiple right-hand sides with multiple shifts for each right-hand side. We develop a method that efficiently solves the multiple right-hand sides by using a deflated version of GMRES and yet keeps costs for all of the multiply shifted systems close to those for one shift. An example is given showing this can be extremely effective with a quantum chromodynamics matrix.     

Increasing efficiency of inverse iteration

Inverse iteration is simple but not very efficient method for computing few eigenvalues with minimal absolute values and corresponding eigenvectors of a symmetric matrix. The idea is to increase its efficiency by technique similar to multigrid methods used for solving linear systems. This approach is not new, but until now multigrid was mostly used for solving linear system which appear in Rayleigh quotient iteration, inverse iteration and related iterative methods. Instead of choosing appropriate coordinates (grids), our algorithm performs inverse iteration on a sequence of subspaces with decreasing dimensions (multispace). Block Lanczos method is used for the selection of a smaller subspace. This will produce a banded matrix, which makes inverse iteration even faster in the smaller dimensions.      

Augmented conjugate gradient. Application in an iterative process for the solution of scattering problems

We discuss the application of an augmented conjugate gradient to the solution of a sequence of linear systems of the same matrix appearing in an iterative process for the solution of scattering problems. The conjugate gradient method applied to the first system generates a Krylov subspace, then for the following systems, a modified conjugate gradient is applied using orthogonal projections on this subspace to compute an initial guess and modified descent directions leading to a better convergence. The scattering problem is treated via an Exact Controllability formulation and a preconditioned conjugate gradient algorithm is introduced. The set of linear systems to be solved are associated to this preconditioning. The efficiency of the method is tested on different 3D acoustic problems. This revised version was published online in August 2006 with corrections to the Cover Date.     

Skew-symmetric methods for nonsymmetric linear systems with multiple right-hand sides

By transforming nonsymmetric linear systems to the extended skew-symmetric ones, we present the skew-symmetric methods for solving nonsymmetric linear systems with multiple right-hand sides. These methods are based on the block and global Arnoldi algorithm which is formed by implementing orthogonal projections of the initial matrix residual onto a matrix Krylov subspace. The algorithms avoid the tediously long Arnoldi process and highly reduce expensive storage. Numerical experiments show that these algorithms are effective and give better practical performances than global GMRES for solving nonsymmetric linear systems with multiple right-hand sides.