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arXiv:1808.10601 · Advanced Quantum Technologies

Quantum Neural Network States: A Brief Review of Methods and Applications

Zhih‐Ahn Jia, Biao Yi, Rui Zhai, Yu‐Chun Wu, Guang‐Can Guo, Guo‐Ping Guo

Published Mar 25, 2019• 119 citations
arXivHTMLPDF

Abstract

Abstract One of the main challenges of quantum many‐body physics is the exponential growth in the dimensionality of the Hilbert space with system size. This growth makes solving the Schrödinger equation of the system extremely difficult. Nonetheless, many physical systems have a simplified internal structure that typically makes the parameters needed to characterize their ground states exponentially smaller. Many numerical methods then become available to capture the physics of the system. Among modern numerical techniques, neural networks, which show great power in approximating functions and extracting features of big data, are now attracting much interest. In this work, the progress in using artificial neural networks to build quantum many‐body states is reviewed. The Boltzmann machine representation is taken as a prototypical example to illustrate various aspects of the neural network states. The classical neural networks are also briefly reviewed, and it is illustrated how to use neural networks to represent quantum states and density operators. Some physical properties of the neural network states are discussed. For applications, the progress in many‐body calculations based on neural network states, the neural network state approach to tomography, and the classical simulation of quantum computing based on Boltzmann machine states are briefly reviewed.

DOI
10.1002/qute.201800077

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Abstract One of the main challenges of quantum many‐body physics is the exponential growth in the dimensionality of the Hilbert space with system size. This growth makes solving the Schrödinger equation of the system extremely difficult. Nonetheless, many physical systems have a simplified internal structure that typically makes the parameters needed to characterize their ground states exponentially smaller. Many numerical methods then become available to capture the physics of the system. Among modern numerical techniques, neural networks, which show great power in approximating functions and extracting features of big data, are now attracting much interest. In this work, the progress in using artificial neural networks to build quantum many‐body states is reviewed. The Boltzmann machine representation is taken as a prototypical example to illustrate various aspects of the neural network states. The classical neural networks are also briefly reviewed, and it is illustrated how to use neural networks to represent quantum states and density operators. Some physical properties of the neural network states are discussed. For applications, the progress in many‐body calculations based on neural network states, the neural network state approach to tomography, and the classical simulation of quantum computing based on Boltzmann machine states are briefly reviewed.
One of the main challenges of quantum many-body physics is that the dimensionality of the Hilbert space grows exponentially with the system size, which makes it extremely difficult to solve the Schrodinger equations of the system. But typically, many physical systems have a simplified internal structure which makes the parameters needed to characterize their ground states exponentially smaller. This makes many numerical methods possible in capture the physics of the system. Among these modern numerical techniques, neural networks, which show great power in approximating functions and extracting features of the big data, are now attracting many interests. Neural network representation of quantum many-body states shows great potential in solving some traditionally difficult quantum problems involving large number of freedoms. In this work, we briefly review the progress of using the artificial neural network to build quantum many-body ansatz states. We take Boltzmann machine representation as a prototypical example to illustrate various aspects of neural network representation of quantum many-body states. We first briefly review the classical neural networks, then we illustrate how to use neural networks to represent quantum states and density operators. Some physical properties of the neural network states, including entanglement features, representational power, and the relation with tensor network states, are discussed. For applications, we briefly review the progress of many-body calculating based on neural network states, neural network state approach to tomography, and also the classical simulation of quantum computing based on Boltzmann machine states. At the end of the work, some outlooks and open problems are given.
Over the past few years, machine learning has emerged as a powerful computational tool to tackle complex problems in a broad range of scientific disciplines.In particular, artificial neural networks have been successfully used to mitigate the exponential complexity often encountered in quantum many-body physics, the study of properties of quantum systems built from a large number of interacting particles.In this article, we review some applications of neural networks in condensed matter physics and quantum information, with particular emphasis on hands-on tutorials serving as a quick start for a newcomer to the field.The prerequisites of this tutorial are basic probability theory and calculus, linear algebra, basic notions of neural networks, statistical physics, and quantum mechanics.The reader is introduced to supervised machine learning with convolutional neural networks to learn a phase transition, unsupervised learning with restricted Boltzmann machines to perform quantum tomography, and the variational Monte Carlo method with recurrent neural networks for approximating the ground state of a many-body Hamiltonian.For each algorithm, we briefly review the key ingredients and their corresponding neuralnetwork implementation, and show numerical experiments for a system of interacting Rydberg atoms in two dimensions.
Over the past years, machine learning has emerged as a powerful computational tool to tackle complex problems over a broad range of scientific disciplines. In particular, artificial neural networks have been successfully deployed to mitigate the exponential complexity often encountered in quantum many-body physics, the study of properties of quantum systems built out of a large number of interacting particles. In this Article, we overview some applications of machine learning in condensed matter physics and quantum information, with particular emphasis on hands-on tutorials serving as a quick-start for a newcomer to the field. We present supervised machine learning with convolutional neural networks to learn a phase transition, unsupervised learning with restricted Boltzmann machines to perform quantum tomography, and variational Monte Carlo with recurrent neural-networks for approximating the ground state of a many-body Hamiltonian. We briefly review the key ingredients of each algorithm and their corresponding neural-network implementation, and show numerical experiments for a system of interacting Rydberg atoms in two dimensions.
Abstract Due to the exponential growth of the Hilbert space dimension with system size, the simulation of quantum many-body systems has remained a persistent challenge until today. Here, we review a relatively new class of variational states for the simulation of such systems, namely neural quantum states (NQS), which overcome the exponential scaling by compressing the state in terms of the network parameters rather than storing all exponentially many coefficients needed for an exact parameterization of the state. We introduce the commonly used NQS architectures and their various applications for the simulation of ground and excited states, finite temperature and open system states as well as NQS approaches to simulate the dynamics of quantum states. Furthermore, we discuss NQS in the context of quantum state tomography.
Part of the challenge for quantum many-body problems comes from the difficulty of representing large-scale quantum states, which in general requires an exponentially large number of parameters. Neural networks provide a powerful tool to represent quantum many-body states. An important open question is what characterizes the representational power of deep and shallow neural networks, which is of fundamental interest due to the popularity of deep learning methods. Here, we give a proof that, assuming a widely believed computational complexity conjecture, a deep neural network can efficiently represent most physical states, including the ground states of many-body Hamiltonians and states generated by quantum dynamics, while a shallow network representation with a restricted Boltzmann machine cannot efficiently represent some of those states.One of the challenges in studies of quantum many-body physics is finding an efficient way to record the large system wavefunctions. Here the authors present an analysis of the capabilities of recently-proposed neural network representations for storing physically accessible quantum states.