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arXiv:1911.02558

TensorTrace: an application to contract tensor networks

Glen Evenbly

Published Nov 6, 2019• 6 citations
arXivHTMLPDF

Abstract

Tensor network methods are a conceptually elegant framework for encoding complicated datasets, where high-order tensors are approximated as networks of low-order tensors. In practice, however, the numeric implementation of tensor network algorithms is often a labor-intensive and error-prone task, even for experienced researchers in this area. \emph{TensorTrace} is application designed to alleviate the burden of contracting tensor networks: it provides a graphic drawing interface specifically tailored for the construction of tensor network diagrams, from which the code for their optimal contraction can then be automatically generated (in the users choice of the MATLAB, Python or Julia languages). \emph{TensorTrace} is freely available at \url{https://www.tensortrace.com} with versions for Windows, Mac and Ubuntu.

DOI
10.48550/arxiv.1911.02558

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Tensor networks (TNs) are a central computational tool in quantum science and artificial intelligence. However, the lack of a unified software interface across tensor-computing frameworks severely limits the portability of TN applications, coupling algorithmic development to specific hardware and software back ends. To address this challenge, we introduce the Tensor Computing Application Programming Interface (TCAPI)---an application-oriented, lightweight API designed to enable framework-independent, high-performance TN applications, currently specified for \texttt{C++} and \texttt{Python}. TCAPI provides well-defined type-system conventions that abstract tensor objects, together with a minimal yet expressive set of core functions for essential tensor manipulations and tensor linear-algebra operations, with operation semantics shared across language specifications. Through numerical demonstrations of representative tensor-network applications implemented in \texttt{C++} using TCAPI, we show that code written against TCAPI can be migrated seamlessly across heterogeneous hardware and software platforms while achieving performance comparable to native framework implementations. We further provide open-source implementations of TCAPI based on \textit{Cytnx} and \textit{ITensor} in \texttt{C++}, and on \textit{NumPy} in \texttt{Python}, demonstrating its practicality and ease of integration with existing tensor-computing frameworks.
High-dimensional data arise naturally in many areas of science and engineering, including machine learning, signal processing, computational physics, and statistics. Such data are often represented as tensors, multi-dimensional generalizations of matrices. While tensors provide a natural representation for multi-modal structure, their direct manipulation quickly becomes challenging as the order grows: the number of parameters increases exponentially, and algebraic expressions involving many indices become difficult to interpret and implement. Tensor networks (TNs) provide an effective framework for addressing these challenges. Originally introduced by Penrose and developed extensively in quantum physics, the graphical language of tensor networks encodes contractions as edges in a graph, reducing notational overhead and revealing structural properties obscured by index notation. Despite the central role of high-dimensional tensors in modern machine learning and numerical analysis, tensor network diagrams remain underutilized outside quantum computing, partly due to the lack of a self-contained mathematical reference accessible to a broad technical audience. This manuscript provides a self-contained guide to tensor networks and their use in tensor algebra. We present the main operations on tensors, contractions, products, and reshaping through, graphical notation, and show how classical tensor decompositions and related computations are naturally expressed in this framework. We also illustrate how tensor networks simplify the derivation of gradients and the manipulation of high-dimensional probability distributions. Throughout, we show that the diagrammatic approach yields genuinely shorter and more transparent proofs of classical identities, rank bounds, and gradient formulas that would otherwise require laborious index manipulation.
We present an overview of the key ideas and skills necessary to begin implementing tensor network methods numerically, which is intended to facilitate the practical application of tensor network methods for researchers that are already versed with their theoretical foundations. These skills include an introduction to the contraction of tensor networks, to optimal tensor decompositions, and to the manipulation of gauge degrees of freedom in tensor networks. The topics presented are of key importance to many common tensor network algorithms such as DMRG, TEBD, TRG, PEPS, and MERA.
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Tensors are a natural generalization of matrices, and tensor networks are a natural generalization of matrix products. Despite the simple definition of tensor networks, they are versatile enough to represent many different kinds of "products" that arise in various theoretical and practical problems. In particular, the powerful computational model of quantum computation can be defined almost entirely in terms of matrix products and tensor products, both of which are special cases of tensor networks. As such, (classical) algorithms for evaluating tensor networks have profound importance in the study of quantum computation. In this thesis, we design and implement a parallel algorithm for tensor network contraction. In addition to finding efficient contraction orders for a tensor network, we also dynamically slice it into multiple sub-tasks with lower space and time costs, in order to evaluate the tensor network in parallel. We refer to such an evaluation strategy as a contraction scheme for the tensor network. In addition, we introduce a local optimization procedure that improves the efficiency of the contraction schemes we find. We also investigate the applications of our parallel tensor network contraction algorithm in quantum computation. The most ready application is the simulation of random quantum supremacy circuits, where we benchmark our algorithm to demonstrate its advantage over other similar tensor network based simulators. Other applications we found include evaluating the energy function of a Quantum Approximate Optimization Algorithm (QAOA), and simulating surface codes under a realistic error model with crosstalk.