Tensor-based multiscale method for diffusion problems in quasi-periodic heterogeneous media

This paper proposes to address the issue of complexity reduction for the numerical simulation of multiscale media in a quasi-periodic setting. We consider a stationary elliptic diffusion equation defined on a domain $D$ such that $\overline{D}$ is the union of cells $\{\overline{D_i}\}_{i\in I}$ and we introduce a two-scale representation by identifying any function $v(x)$ defined on $D$ with a bi-variate function $v(i,y)$, where $i \in I$ relates to the index of the cell containing the point $x$ and $y \in Y$ relates to a local coordinate in a reference cell $Y$. We introduce a weak formulation of the problem in a broken Sobolev space $V(D)$ using a discontinuous Galerkin framework. The problem is then interpreted as a tensor-structured equation by identifying $V(D)$ with a tensor product space $\mathbb{R}^I \otimes V(Y)$ of functions defined over the product set $I\times Y$. Tensor numerical methods are then used in order to exploit approximability properties of quasi-periodic solutions by low-rank tensors.Comment: Changed the choice of test spaces V(D) and X (with regard to regularity) and the argumentation thereof. Corrected proof of proposition 3. Corrected wrong multiplicative factor in proposition 4 and its proof (was 2 instead of 1). Added remark 6 at the end of section 2. Extended remark 7. Added references. Some minor improvements (typos, typesetting

Block Circulant and Toeplitz Structures in the Linearized Hartree–Fock Equation on Finite Lattices: Tensor Approach

This paper introduces and analyses the new grid-based tensor approach to approximate solution of the elliptic eigenvalue problem for the 3D lattice-structured systems. We consider the linearized Hartree-Fock equation over a spatial $L_1\times L_2\times L_3$ lattice for both periodic and non-periodic problem setting, discretized in the localized Gaussian-type orbitals basis. In the periodic case, the Galerkin system matrix obeys a three-level block-circulant structure that allows the FFT-based diagonalization, while for the finite extended systems in a box (Dirichlet boundary conditions) we arrive at the perturbed block-Toeplitz representation providing fast matrix-vector multiplication and low storage size. The proposed grid-based tensor techniques manifest the twofold benefits: (a) the entries of the Fock matrix are computed by 1D operations using low-rank tensors represented on a 3D grid, (b) in the periodic case the low-rank tensor structure in the diagonal blocks of the Fock matrix in the Fourier space reduces the conventional 3D FFT to the product of 1D FFTs. Lattice type systems in a box with Dirichlet boundary conditions are treated numerically by our previous tensor solver for single molecules, which makes possible calculations on rather large $L_1\times L_2\times L_3$ lattices due to reduced numerical cost for 3D problems. The numerical simulations for both box-type and periodic $L\times 1\times 1$ lattice chain in a 3D rectangular "tube" with $L$ up to several hundred confirm the theoretical complexity bounds for the block-structured eigenvalue solvers in the limit of large $L$.Comment: 30 pages, 12 figures. arXiv admin note: substantial text overlap with arXiv:1408.383

A literature survey of low-rank tensor approximation techniques

During the last years, low-rank tensor approximation has been established as a new tool in scientific computing to address large-scale linear and multilinear algebra problems, which would be intractable by classical techniques. This survey attempts to give a literature overview of current developments in this area, with an emphasis on function-related tensors

Application of Hierarchical Matrix Techniques To The Homogenization of Composite Materials

In this paper, we study numerical homogenization methods based on integral equations. Our work is motivated by materials such as concrete, modeled as composites structured as randomly distributed inclusions imbedded in a matrix. We investigate two integral reformulations of the corrector problem to be solved, namely the equivalent inclusion method based on the Lippmann-Schwinger equation, and a method based on boundary integral equations. The fully populated matrices obtained by the discretization of the integral operators are successfully dealt with using the H-matrix format