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Efficiency supremacy of bit-encoded neural networks for Fock states

Oliver Kaestle, Alexander Carmele

Published Mar 15, 2021• 0 citations
OpenAlex

Abstract

Artificial neural networks have been established as a universally applicable tool in both science and industry. In the context of symmetric open quantum systems, specifically the restricted Boltzmann machine architecture has emerged as a natural and highly compressed representation of the density matrix for open spin-$1/2$ quantum systems via a direct mapping of spins to the visible neuron layer. Here we present a bit encoding scheme for a highly efficient and scalable representation of bosonic Fock number states in the restricted Boltzmann machine neural network architecture, extending its applicability beyond pure spin-$1/2$ open quantum systems. In contrast to common density matrix implementations, the complexity of the neural network scales only with the number of bit-encoded neurons rather than the maximum boson number. Crucially, in the high occupation regime its information compression efficiency is shown to surpass even maximally optimized density matrix implementations, where a projector method is used to access the sparsest Hilbert space representation available.

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Artificial neural networks have been established as a universally applicable tool in both science and industry. In the context of symmetric open quantum systems, specifically the restricted Boltzmann machine architecture has emerged as a natural and highly compressed representation of the density matrix for open spin-1/21/21/2 quantum systems via a direct mapping of spins to the visible neuron layer. Here we present a bit encoding scheme for a highly efficient and scalable representation of bosonic Fock number states in the restricted Boltzmann machine neural network architecture, extending its applicability beyond pure spin-1/21/21/2 open quantum systems. In contrast to common density matrix implementations, the complexity of the neural network scales only with the number of bit-encoded neurons rather than the maximum boson number. Crucially, in the high occupation regime its information compression efficiency is shown to surpass even maximally optimized density matrix implementations, where a projector method is used to access the sparsest Hilbert space representation available.
We present a bit encoding scheme for a highly efficient and scalable representation of bosonic Fock number states in the restricted Boltzmann machine neural network architecture. In contrast to common density matrix implementations, the complexity of the neural network scales only with the number of bit-encoded neurons rather than the maximum boson number. Crucially, in the high occupation regime its information compression efficiency is shown to surpass even maximally optimized density matrix implementations, where a projector method is used to access the sparsest Hilbert space representation available.
Abstract Obtaining accurate properties of many-body interacting quantum matter is a long-standing challenge in theoretical physics and chemistry, rooting into the complexity of the many-body wave-function. Classical representations of many-body states constitute a key tool for both analytical and numerical approaches to interacting quantum problems. Here, we introduce a technique to construct classical representations of many-body quantum systems based on artificial neural networks. Our constructions are based on the deep Boltzmann machine architecture, in which two layers of hidden neurons mediate quantum correlations. The approach reproduces the exact imaginary-time evolution for many-body lattice Hamiltonians, is completely deterministic, and yields networks with a polynomially-scaling number of neurons. We provide examples where physical properties of spin Hamiltonians can be efficiently obtained. Also, we show how systematic improvements upon existing restricted Boltzmann machines ansatze can be obtained. Our method is an alternative to the standard path integral and opens new routes in representing quantum many-body states.
As neural networks are known to efficiently represent classes of tensor-network states as well as volume-law-entangled states, identifying which properties determine the representational capabilities of neural quantum states (NQS) remains an open question. We construct NQS representations of ground states of medium-mass atomic nuclei, which typically exhibit significant entanglement and non-stabilizerness, to study their performance in relation to the quantum complexity of the target state. Leveraging a second-quantized formulation of NQS tailored for nuclear-physics applications, we perform calculations in active orbital spaces using a restricted Boltzmann machine (RBM), a prototypical NQS ansatz. For a fixed number of configurations, we find that states with larger non-stabilizerness are systematically harder to learn, as evidenced by reduced accuracy. This finding suggests that non-stabilizerness is a primary factor governing the compression and representational efficiency of RBMs in entangled regimes, and motivates extending these studies to more sophisticated network architectures.
Obtaining accurate properties of many-body interacting quantum matter is a long-standing challenge in theoretical physics and chemistry, rooting into the complexity of the many-body wave-function. Classical representations of many-body states constitute a key tool for both analytical and numerical approaches to interacting quantum problems. Here, we introduce a technique to construct classical representations of many-body quantum systems based on artificial neural networks. Our constructions are based on the deep Boltzmann machine architecture, in which two layers of hidden neurons mediate quantum correlations. The approach reproduces the exact imaginary-time evolution for many-body lattice Hamiltonians, is completely deterministic, and yields networks with a polynomially-scaling number of neurons. We provide examples where physical properties of spin Hamiltonians can be efficiently obtained. Also, we show how systematic improvements upon existing restricted Boltzmann machines ansatze can be obtained. Our method is an alternative to the standard path integral and opens new routes in representing quantum many-body states.
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.
Neural network quantum states such as ansatz wave functions have shown a great deal of promise for finding the ground state of spin models. Recently, work has focused on extending this idea to mixed states for simulating the dynamics of open systems. Most approaches so far have used a purification ansatz where a copy of the system Hilbert space is added, which when traced out gives the correct density matrix. Here we instead present an extension of the restricted Boltzmann machine which directly represents the density matrix in Liouville space. This allows the compact representation of states which appear in mean-field theory. We benchmark our approach on two different versions of the dissipative transverse-field Ising model, which show our ansatz is able to compete with other state-of-the-art approaches. Published by the American Physical Society 2024