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.     

ChebStaBlkCG: A block variant of ChebFilterCG

The behavior of ChebFilterCG (an algorithm that combines the Chebyshev filter and Conjugate Gradient) applied to systems with unfavorable eigenvalue distribution is examined. To improve the convergence, a hybrid approach combining a stabilized version of the block conjugated gradient with Chebyshev polynomials as preconditioners (ChebStaBlkCG) is proposed. The performance of ChebStaBlkCG is illustrated and validated on a set of linear systems. It is shown how ChebStaBlkCG can be used to accelerate the block Cimmino method and to solve linear systems with multiple right‐hand sides.     

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.     

Improved seed methods for symmetric positive definite linear equations with multiple right‐hand sides

We consider symmetric positive definite systems of linear equations with multiple right‐hand sides. The seed conjugate gradient (CG) method solves one right‐hand side with the CG method and simultaneously projects over the Krylov subspace thus developed for the other right‐hand sides. Then the next system is solved and used to seed the remaining ones. Rounding error in the CG method limits how much the seeding can improve convergence. We propose three changes to the seed CG method: only the first right‐hand side is used for seeding, this system is solved past convergence, and the roundoff error is controlled with some reorthogonalization. We will show that results are actually better with only one seeding, even in the case of related right‐hand sides. Controlling rounding error gives the potential for rapid convergence for the second and subsequent right‐hand sides. Polynomial preconditioning can help reduce storage needed for reorthogonalization. The new seed methods are applied to examples including matrices from quantum chromodynamics. Copyright © 2013 John Wiley & Sons, Ltd.     

Extending the eigCG algorithm to nonsymmetric Lanczos for linear systems with multiple right‐hand sides

The technique that was used to build the eigCG algorithm for sparse symmetric linear systems is extended to the nonsymmetric case using the BiCG algorithm. We show that, similar to the symmetric case, we can build an algorithm that is capable of computing a few smallest magnitude eigenvalues and their corresponding left and right eigenvectors of a nonsymmetric matrix using only a small window of the BiCG residuals while simultaneously solving a linear system with that matrix. For a system with multiple right‐hand sides, we give an algorithm that computes incrementally more eigenvalues while solving the first few systems and then uses the computed eigenvectors to deflate BiCGStab for the remaining systems. Our experiments on various test problems, including Lattice QCD, show the remarkable ability of eigBiCG to compute spectral approximations with accuracy comparable with that of the unrestarted, nonsymmetric Lanczos. Furthermore, our incremental eigBiCG followed by appropriately restarted and deflated BiCGStab provides a competitive method for systems with multiple right‐hand sides. Copyright © 2013 John Wiley & Sons, Ltd.     

TWO ALGORITHMS FOR SYMMETRIC LINEAR SYSTEMS WITH MULTIPLE RIGHT-HAND SIDES

1　ＩｎｔｒｏｄｕｃｔｉｏｎＩｎｍａｎｙａｐｐｌｉｃａｔｉｏｎｓｗｅｎｅｅｄｔｏｓｏｌｖｅｍｕｌｔｉｐｌｅｓｙｓｔｅｍｓｏｆｌｉｎｅａｒｅｑｕａｔｉｏｎｓＡｘ(ｉ) =ｂ(ｉ) ,ｉ=1,… ,ｓ (1)ｗｉｔｈｔｈｅｓａｍｅｎ×ｎｒｅａｌｓｙｍｍｅｔｒｉｃｃｏｅｆｆｉｃｉｅｎｔｍａｔｒｉｘＡ ,ｂｕｔｓｄｉｆｆｅｒｅｎｔｒｉｇｈｔ ｈａｎｄｓｉｄｅｓｂ(ｉ) (ｉ=1,… ,ｓ) .Ｉｆａｌｌｏｆｔｈｅｒｉｇｈｔ ｈａｎｄｓｉｄｅｓａｒｅａｖａｉｌａｂｌｅｓｉｍｕｌｔａｎｅｏｕｓｌｙ ,ｔｈｅｎｔｈｅｓｅｓｌｉｎｅａｒｓｙｓｔｅ…     

A simpler GMRES and its adaptive variant for shifted linear systems

A variant of the simpler GMRES method is developed for solving shifted linear systems (SGMRES‐Sh), exhibiting almost the same advantage of the simpler GMRES method over the regular GMRES method. Because the remedy adapted by GMRES‐Sh is no longer feasible for SGMRES‐Sh due to the differences between simpler GMRES and GMRES for constructing the residual vectors of linear systems, we take an alternative strategy to force the residual vectors of the add system also be orthogonal to the subspaces, to which the residual vectors of the seed system are orthogonal when the seed system is solved with the simpler GMRES method. In addition, a seed selection strategy is also employed for solving the rest non‐converged linear systems. Furthermore, an adaptive version of SGMRES‐Sh is presented for the purpose of improving the stability of SGMRES‐Sh based on the technique of the adaptive choice of the Krylov subspace basis developed for the adaptive simpler GMRES. Numerical experiments demonstrate the benefits of the presented methods.     

Application of the Lanczos algorithm for solving the linear systems that occur in continuation problems

We study the Lanczos method for solving symmetric linear systems with multiple right‐hand sides. First, we propose a numerical method of implementing the Lanczos method, which can provide all approximations to the solution vectors of the remaining linear systems. We also seek possible application of this algorithm for solving the linear systems that occur in continuation problems. Sample numerical results are reported. Copyright © 2002 John Wiley & Sons, Ltd.     

Block s‐step Krylov iterative methods

Block (including s‐step) iterative methods for (non)symmetric linear systems have been studied and implemented in the past. In this article we present a (combined) block s‐step Krylov iterative method for nonsymmetric linear systems. We then consider the problem of applying any block iterative method to solve a linear system with one right‐hand side using many linearly independent initial residual vectors. We present a new algorithm which combines the many solutions obtained (by any block iterative method) into a single solution to the linear system. This approach of using block methods in order to increase the parallelism of Krylov methods is very useful in parallel systems. We implemented the new method on a parallel computer and we ran tests to validate the accuracy and the performance of the proposed methods. It is expected that the block s‐step methods performance will scale well on other parallel systems because of their efficient use of memory hierarchies and their reduction of the number of global communication operations over the standard methods. Copyright © 2009 John Wiley & Sons, Ltd.     

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.     

A real-valued block conjugate gradient type method for solving complex symmetric linear systems with multiple right-hand sides

We consider solving complex symmetric linear systems with multiple right-hand sides. We assume that the coefficient matrix has indefinite real part and positive definite imaginary part. We propose a new block conjugate gradient type method based on the Schur complement of a certain 2-by-2 real block form. The algorithm of the proposed method consists of building blocks that involve only real arithmetic with real symmetric matrices of the original size. We also present the convergence property of the proposed method and an efficient algorithmic implementation. In numerical experiments, we compare our method to a complex-valued direct solver, and a preconditioned and nonpreconditioned block Krylov method that uses complex arithmetic.     

On solution of total least squares problems with multiple right-hand sides

Consider a linear approximation problem AX≈B with multiple right–hand sides. When errors in the data are confirmed both to B and A, the total least squares (TLS) concept is used to solve this problem. Contrary to the standard least squares approximation problem, a solution of the TLS problem may not exist. For a single (vector) right–hand side, the classical theory has been developed by G.H. Golub, C.F. Van Loan [2], and S. Van Huffel, J. Vandewalle [4], and then complemented recently by the core problem approach of C.C. Paige, Z. Strakoš [5,6,7]. Analysis of the problem with multiple right–hand sides is still under development. In this short contribution we present conditions for the existence of a TLS solution. (© 2008 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim)     

Smoothing iterative block methods for linear systems with multiple right-hand sides

In the present paper, we present smoothing procedures for iterative block methods for solving nonsymmetric linear systems of equations with multiple right-hand sides. These procedures generalize those known when solving one right-hand linear systems. We give some properties of these new methods and then, using these procedures we show connections between some known iterative block methods. Finally we give some numerical examples.     

Preconditioning systems arising from the KKR Green function method using block-circulant matrices

Recently, a linearly scaling method for the calculation of the electronic structure based on the Korringa–Kohn–Rostoker Green function method has been proposed. The method uses the transpose free quasi minimal residual method (TFQMR) to solve linear systems with multiple right hand sides. These linear systems depend on the energy-level under consideration and the convergence rate deteriorates for some of these energy points. While traditional preconditioners like ILU are fairly useful for the problem, the computation of the preconditioner itself is often relatively hard to parallelize. To overcome these difficulties, we develop a new preconditioner that exploits the strong structure of the underlying systems. The resulting preconditioner is block-circulant and thus easy to compute, invert and parallelize. The resulting method yields a dramatic speedup of the computation compared to the unpreconditioned solver, especially for critical energy levels.     

Block Descent Methods and Hybrid Procedures for Linear Systems

In this paper, we define and study several types of block descent methods for the simultaneous solution of a system of linear equations with several right hand sides. Then, improved block EN methods will be proposed. Finally, block hybrid and minimal residual smoothing procedures will be considered.     

A new family of global methods for linear systems with multiple right-hand sides

The global bi-conjugate gradient (Gl-BCG) method is an attractive matrix Krylov subspace method for solving nonsymmetric linear systems with multiple right-hand sides, but it often show irregular convergence behavior in many applications. In this paper, we present a new family of global A-biorthogonal methods by using short two-term recurrences and formal orthogonal polynomials, which contain the global bi-conjugate residual (Gl-BCR) algorithm and its improved version. Finally, numerical experiments illustrate that the proposed methods are highly competitive and often superior to originals.     

Approximate solutions to large nonsymmetric differential Riccati problems with applications to transport theory

In this paper, we consider large‐scale nonsymmetric differential matrix Riccati equations with low‐rank right‐hand sides. These matrix equations appear in many applications such as control theory, transport theory, applied probability, and others. We show how to apply Krylov‐type methods such as the extended block Arnoldi algorithm to get low‐rank approximate solutions. The initial problem is projected onto small subspaces to get low dimensional nonsymmetric differential equations that are solved using the exponential approximation or via other integration schemes such as backward differentiation formula (BDF) or Rosenbrock method. We also show how these techniques can be easily used to solve some problems from the well‐known transport equation. Some numerical examples are given to illustrate the application of the proposed methods to large‐scale problems.     

Limited memory preconditioners for symmetric indefinite problems with application to structural mechanics

This paper presents a class of limited memory preconditioners (LMP) for solving linear systems of equations with symmetric indefinite matrices and multiple right‐hand sides. These preconditioners based on limited memory quasi‐Newton formulas require a small number k of linearly independent vectors and may be used to improve an existing first‐level preconditioner. The contributions of the paper are threefold. First, we derive a formula to characterize the spectrum of the preconditioned operator. A spectral analysis of the preconditioned matrix shows that the eigenvalues are all real and that the LMP class is able to cluster at least k eigenvalues at 1. Secondly, we show that the eigenvalues of the preconditioned matrix enjoy interlacing properties with respect to the eigenvalues of the original matrix provided that the k linearly independent vectors have been prior projected onto the invariant subspaces associated with the eigenvalues of the original matrix in the open right and left half‐plane, respectively. Third, we focus on theoretical properties of the Ritz‐LMP variant, where Ritz information is used to determine the k vectors. Finally, we illustrate the numerical behaviour of the Ritz limited memory preconditioners on realistic applications in structural mechanics that require the solution of sequences of large‐scale symmetric saddle‐point systems. Numerical experiments show the relevance of the proposed preconditioner leading to a significant decrease in terms of computational operations when solving such sequences of linear systems. A saving of up to 43% in terms of computational effort is obtained on one of these applications. Copyright © 2016 John Wiley & Sons, Ltd.     

非Hermite线性方程组的若干预处理迭代算法

非Hermite线性方程组在科学和工程计算中有着重要的理论研究意义和使用价值,因此如何高效求解该类线性方程组,一直是研究者所探索的方向.通过提出一种预处理方法,对非Hermite线性方程组和具有多个右端项的复线性方程组求解的若干迭代算法进行预处理,旨在提高原算法的收敛速度.最后通过数值试验表明,所提出的若干预处理迭代算法与原算法相比较,预处理算法迭代次数大大降低,且收敛速度明显优于原算法.除此之外,广义共轭A-正交残量平方法(GCORS2)的预处理算法与其他算法相比,具有良好的收敛性行为和较好的稳定性.     

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