Tensors arise naturally in high-dimensional problems in chemistry, financial mathematics, and many other areas. The numerical treatment of such problems is difficult due to the curse of dimensionality: the number of unknowns and the computational complexity grow exponentially with the dimension of the problem. To break the curse of dimensionality, low-parametric representations, or formats, have to be used. In this paper we make use of the TT-format (tensor-train format) which is one of the most effective stable representations of high-dimensional tensors. Basic linear algebra operations in the TT-format are now well developed. Our goal is to provide a “black-box” type of solver for linear systems where both the matrix and the right-hand side are in the TT-format. An efficient DMRG (density matrix renormalization group) method is proposed, and several tricks are employed to make it work. The numerical experiments confirm the effectiveness of our approach.
The simulation and analysis of high-dimensional problems is often infeasible due to the curse of dimensionality. In this thesis, we investigate the potential of tensor decompositions for mitigating this curse when considering systems from several application areas. Using tensor-based solvers, we directly compute numerical solutions of master equations associated with Markov processes on extremely large state spaces. Furthermore, we exploit the tensor-train format to approximate eigenvalues and corresponding eigentensors of linear tensor operators. In order to analyze the dominant dynamics of high- dimensional stochastic processes, we propose several decomposition techniques for highly diverse problems. These include tensor representations for operators based on nearest-neighbor interactions, construction of pseudoinverses for tensor-based reformulations of dimensionality reduction methods, and the approximation of transfer operators of dynamical systems. The results show that the tensor-train format enables us to compute low-rank approximations for various numerical problems as well as to reduce the memory consumption and the computational costs compared to classical approaches significantly. We demonstrate that tensor decompositions are a powerful tool for solving high-dimensional problems from various application areas.
Abstract The tensor renormalization group (TRG) is a highly effective method for calculating the free energy of lattice models and has demonstrated exceptional accuracy for several low-dimensional systems. However, its application to higher-dimensional models is often hampered by a large memory footprint and high computational cost. In this paper, we propose a new algorithm, “tt-lattice”, which approximates the tensor at each lattice vertex using a tensor train (tt) decomposition. The algorithm is designed to maintain the tt-format throughout the TRG computation, which significantly reduces both memory usage and computational cost. For a uniform lattice model, the computational cost of tt-lattice scales as
O(d2log(L)χ6), with the largest intermediate tensor size of
O(χ4), where d is the lattice dimension, L is the linear size of each lattice axis, and
χ is the cutoff of the number of lattice edge states. To validate our algorithm, we conducted numerical experiments on a Gaussian field model, for which the exact free energy is computable in any lattice dimensions. The results demonstrate that the tt-lattice method can calculate the free energy with reasonable accuracy even for a 10D lattice model with modern computational architectures.
We discuss extended definitions of linear and multilinear operations such as Kronecker, Hadamard, and contracted products, and establish links between them for tensor calculus. Then we introduce effective low-rank tensor approximation techniques including Candecomp/Parafac (CP), Tucker, and tensor train (TT) decompositions with a number of mathematical and graphical representations. We also provide a brief review of mathematical properties of the TT decomposition as a low-rank approximation technique. With the aim of breaking the curse-of-dimensionality in large-scale numerical analysis, we describe basic operations on large-scale vectors, matrices, and high-order tensors represented by TT decomposition. The proposed representations can be used for describing numerical methods based on TT decomposition for solving large-scale optimization problems such as systems of linear equations and symmetric eigenvalue problems.
The tensor train (TT) model is widely used to approximate high-dimensional tensors, enabling efficient handling of data that may exceed available memory. TT helps address the curse of dimensionality in applications such as system identification and dynamic programming. In some applications, TT is known as a ``matrix product state" (MPS). The last product is also known under the acronym MPO--MPS. The proposed algorithms achieve an improved trade-off between computational efficiency and accuracy compared to state-of-the-art methods.
Quantification of stochastic or quantum systems by a joint probability density or wave function is a notoriously difficult computational problem, since the solution depends on all possible states (or realizations) of the system. Due to this combinatorial flavor, even a system containing as few as ten particles may yield as many as
1010 discretized states. None of even modern supercomputers are capable to cope with this curse of dimensionality straightforwardly, when the amount of quantum particles, for example, grows up to more or less interesting order of hundreds. A traditional approach for a long time was to avoid models formulated in terms of probabilistic functions, and simulate particular system realizations in a randomized process. Since different times in different communities, data-sparse methods came into play. Generally, they aim to define all data points indirectly, by a map from a low amount of representers, and recast all operations (e.g. linear system solution) from the initial data to the effective parameters. The most advanced techniques can be applied (at least, tried) to any given array, and do not rely explicitly on its origin. The current work contributes further progress to this area in the particular direction: tensor product methods for separation of variables. The separation of variables has a long history, and is based on the following elementary concept: a function of many variables may be expanded as a product of univariate functions. On the discrete level, a function is encoded by an array of its values, or a tensor. Therefore, instead of a huge initial array, the separation of variables allows to work with univariate factors with much less efforts. The dissertation contains a short overview of existing tensor representations: canonical PARAFAC, Hierarchical Tucker, Tensor Train (TT) formats, as well as the artificial tensorisation, resulting in the Quantized Tensor Train (QTT) approximation method. The contribution of the dissertation consists in both theoretical constructions and practical numerical algorithms for high-dimensional models, illustrated on the examples of the Fokker-Planck and the chemical master equations. Both arise from stochastic dynamical processes in multiconfigurational systems, and govern the evolution of the probability function in time. A special focus is put on time propagation schemes and their properties related to tensor product methods. We show that these applications yield large-scale systems of linear equations, and prove analytical separable representations of the involved functions and operators. We propose a new combined tensor format (QTT-Tucker), which descends from the TT format (hence TT algorithms may be generalized smoothly), but provides complexity reduction by an order of magnitude. We develop a robust iterative solution algorithm, constituting most advantageous properties of the classical iterative methods from numerical analysis and alternating density matrix renormalization group (DMRG) techniques from quantum physics. Numerical experiments confirm that the new method is preferable to DMRG algorithms. It is as fast as the simplest alternating schemes, but as reliable and accurate as the Krylov methods in linear algebra.
A simple nonrecursive form of the tensor decomposition in d dimensions is presented. It does not inherently suffer from the curse of dimensionality, it has asymptotically the same number of parameters as the canonical decomposition, but it is stable and its computation is based on low-rank approximation of auxiliary unfolding matrices. The new form gives a clear and convenient way to implement all basic operations efficiently. A fast rounding procedure is presented, as well as basic linear algebra operations. Examples showing the benefits of the decomposition are given, and the efficiency is demonstrated by the computation of the smallest eigenvalue of a 19-dimensional operator.