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arXiv:2201.00810 · Physical review. B./Physical review. B

Matrix product states with backflow correlations

Guglielmo Lami, Giuseppe Carleo, Mario Collura

Published Aug 10, 2022• 14 citations
arXivHTMLPDF

Abstract

By taking inspiration from the backflow transformation for correlated systems, we introduce a tensor network Ansatz which extends the well-established matrix product state representation of a quantum many-body wave function. This structure provides enough resources to ensure that states in dimensions larger than or equal to one obey an area law for entanglement. It can be efficiently manipulated to address the ground-state search problem by means of an optimization scheme which mixes tensor-network and variational Monte Carlo algorithms. We benchmark the Ansatz against spin models both in one and two dimensions, demonstrating high accuracy and precision. We finally employ our approach to study the challenging $S=1/2$ two-dimensional (2D) ${J}_{1}\text{\ensuremath{-}}{J}_{2}$ model, demonstrating that it is competitive with the state-of-the-art methods in 2D.

DOI
10.1103/physrevb.106.l081111

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By taking inspiration from the backflow transformation for correlated systems, we introduce a tensor network Ansatz which extends the well-established matrix product state representation of a quantum many-body wave function. This structure provides enough resources to ensure that states in dimensions larger than or equal to one obey an area law for entanglement. It can be efficiently manipulated to address the ground-state search problem by means of an optimization scheme which mixes tensor-network and variational Monte Carlo algorithms. We benchmark the Ansatz against spin models both in one and two dimensions, demonstrating high accuracy and precision. We finally employ our approach to study the challenging S=1/2S=1/2S=1/2 two-dimensional (2D) J1\ensuremath-J2{J}_{1}\text{\ensuremath{-}}{J}_{2}J1​\ensuremath-J2​ model, demonstrating that it is competitive with the state-of-the-art methods in 2D.
We propose an efficient numerical method, which combines the advantages of recently developed tensor-network based methods and standard trial wave functions, to study the ground-state properties of quantum many-body systems. In this approach, we apply a projector in the form of a tensor-product operator to an input wave function, such as a Jastrow-type or Hartree-Fock wave function, and optimize the tensor elements via variational Monte Carlo. The entanglement already contained in the input wave function can considerably reduce the bond dimensions compared to the regular tensor-product state representation. In particular, this allows us to also represent states that do not obey the area law of entanglement entropy. In addition, for fermionic systems, the fermion sign structure can be encoded in the input wave function. We show that the optimized states provide good approximations of the ground-state energy and correlation functions in the cases of two-dimensional bosonic and fermonic systems.
This chapter introduces the tensor network ansatz for a quantum state whose entanglement entropy obeys the so-called area law with or without logarithmic corrections. This ansatz represents a quantum many-body wave function by a network product of local tensors defined on the lattice sites and treats all tensor elements as variational parameters. It includes, for example, one-dimensional matrix product states (MPS) and two-dimensional projected entangled pair states (PEPS) or projected entangled simplex states (PESS). A typical example is the spin-1 AKLT chain, whose ground state can be exactly represented as an MPS. If a logarithmic correction to the entanglement area law emerges, a tensor network state termed the multi-scale entanglement renormalization ansatz (MERA) describes the entanglement structure of the ground state more accurately in one dimension.
We introduce Neural Tensor Network States (νννTNS), a variational many-body wave-function ansatz that integrates deep neural networks with tensor-network architectures. In the νννTNS framework, a neural network serves as a disentangler of the wave-function, transforming the physical degrees of freedom into renormalized variables with much less entanglement. The renormalized state is then efficiently encoded by a back-flow tensor network. This construction yields a compact yet highly expressive representation of strongly correlated quantum states. Using convolutional neural networks combined with matrix product states as a concrete implementation, we obtain state-of-the-art variational energies for the spin-1/21/21/2 J1J_1J1​-J2J_2J2​ Heisenberg model on the square lattice at the highly frustrated point J2/J1=0.5J_2/J_1=0.5J2​/J1​=0.5, for systems up to 20×2020\times 2020×20 with periodic boundary conditions. Finite-size scaling of spin, dimer, and plaquette correlations exhibits power-law decay without magnetic or valence-bond long-range order, consistent with a gapless quantum spin-liquid ground state at that point.This νννTNS framework is flexible and naturally extensible to other neural and tensor-network structures, offering a general platform for investigating strongly correlated quantum many-body systems.
The Thesis explores the application of Matrix Product States (MPS) in the domain of quantum many-body systems and quantum computing, show casing the versatility and effectiveness of MPS for addressing complex com putational challenges. The opening chapter introduces essential tools for Tensor Networks, addressing the curse of dimensionality and elucidating the main characteristics of Matrix Product States and Matrix Product Op erators. The discussion encompasses also important numerical techniques, including Density Matrix Renormalization Group and Time Evolving Block Decimation. Furthermore, the relation between MPS and quantum circuits is discussed. The subsequent Chapters delve into specific applications of MPS. In the second Chapter, we introduce a Tensor Network ansatz inspired by the backflow transformation for correlated systems. This extension of the MPS representation ensures an area law for entanglement in dimensions one or greater. We employ an optimization scheme combining DMRG and variational Monte Carlo algorithms for efficient ground-state search. Bench marking against spin models demonstrates high accuracy. The third Chapter explores quantum annealing for optimizing complex classical spin Hamil tonians, as the Hopfield model and the binary perceptron. We introduce an efficient Tensor Network representation for the adiabatic time evolution of quantum annealing, enabling scalable classical simulations. The use of MPS in mitigating Trotter errors and mapping to quantum circuits is also explored. In the fourth Chapter we present a novel method for evaluating the amount of nonstabilizerness (also known as quantum magic) contained in an MPS. We overcome the exponentially hard evaluation of this quan tity by employing a simple perfect sampling technique of Pauli string. Our innovative MPS approach enables efficient computation. Benchmarked on magic states and the quantum Ising chain ground state, this method offers easy access to the non-equilibrium dynamics of nonstabilizerness following a quantum quench. The Appendices provide additional insights, including: an introduction to variational Monte Carlo, technical details on MPS simula tions for the quantum annealing and a comprehensive overview on stabilizer formalism and nonstabilizerness.
Based on the scheme of variational Monte Carlo sampling, we develop an accurate and efficient two-dimensional tensor-network algorithm to simulate quantum lattice models. We find that Monte Carlo sampling shows huge advantages in dealing with finite projected entangled pair states, which allows significantly enlarged system size and improves the accuracy of tensor network simulation. We demonstrate our method on the square-lattice antiferromagnetic Heisenberg model up to $32\ifmmode\times\else\texttimes\fi{}32$ sites, as well as a highly frustrated ${J}_{1}\ensuremath{-}{J}_{2}$ model up to $24\ifmmode\times\else\texttimes\fi{}24$ sites. The results, including ground state energy and spin correlations, are in excellent agreement with those of the available quantum Monte Carlo or density matrix renormalization group methods. Therefore, our method substantially advances the calculation of 2D tensor networks for finite systems, and potentially opens a new door towards resolving many challenging strongly correlated quantum many-body problems.
We introduce a novel tensor network structure augmenting the well-established tree tensor network representation of a quantum many-body wave function. The new structure satisfies the area law in high dimensions remaining efficiently manipulatable and scalable. We benchmark this novel approach against paradigmatic two-dimensional spin models demonstrating unprecedented precision and system sizes. Finally, we compute the ground state phase diagram of two-dimensional lattice Rydberg atoms in optical tweezers observing nontrivial phases and quantum phase transitions, providing realistic benchmarks for current and future two-dimensional quantum simulations.