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arXiv:1209.0454 · Physical Review B

Projected entangled pair states at finite temperature: Imaginary time evolution with ancillas

Piotr Czarnik, Łukasz Cincio, Jacek Dziarmaga

Published Dec 5, 2012• 100 citations
arXivHTMLPDF

Abstract

A projected entangled pair state (PEPS) with ancillas is evolved in imaginary time. This tensor network represents a thermal state of a two-dimensional (2D) lattice quantum system. A finite-temperature phase diagram of the 2D quantum Ising model in a transverse field is obtained as a benchmark application.
DOI
10.1103/physrevb.86.245101

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A projected entangled pair state (PEPS) with ancillas can be evolved in imaginary time to obtain thermal states of a strongly correlated quantum system on a two-dimensional lattice. Every application of a Suzuki-Trotter gate multiplies the PEPS bond dimension DDD by a factor kkk. It has to be renormalized back to the original DDD. In order to preserve the accuracy of the Suzuki-Trotter (ST) decomposition, the renormalization in principle has to take into account full environment made of the new tensors with the bond dimension $k\ifmmode\times\else\texttimes\fi{}D$. Here, we propose a self-consistent renormalization procedure operating with the original bond dimension DDD, but without compromising the accuracy of the ST decomposition. The iterative procedure renormalizes the bond using full environment made of renormalized tensors with the bond dimension DDD. After every renormalization, the new renormalized tensors are used to update the environment, and then the renormalization is repeated again and again until convergence. As a benchmark application, we obtain thermal states of the transverse field quantum Ising model on a square lattice, both infinite and finite, evolving the system across a second-order phase transition at finite temperature.
The minimally entangled typical thermal states (METTS) are an ensemble of pure states, equivalent to the Gibbs thermal state, designed with an efficient tensor network representation in mind. In this article, we use the projected entangled pair states (PEPS) as their representation on a two-dimensional (2D) lattice. Unlike matrix product states (MPS), which for 2D systems are limited by an exponential computational barrier in the lattice size, PEPS provides a more tractable approach. To substantiate the prowess of PEPS in modeling METTS (dubbed PEPS-METTS), we benchmark it against the purification method in the context of the 2D quantum Ising model at its critical temperature. Our analysis reveals that PEPS-METTS achieves accurate results with significantly lower bond dimensions. We further corroborate this finding in the 2D Fermi-Hubbard model. At a technical level, we introduce an efficient zipper method to obtain PEPS boundary MPS needed to compute expectation values and perform sampling. The imaginary time evolution is done with the neighborhood tensor update.
A typical quantum state obeying the area law for entanglement on an infinite two-dimensional (2D) lattice can be represented by a tensor network Ansatz, known as an infinite projected entangled pair state (iPEPS), with a finite bond dimension DDD. Its real-imaginary time evolution can be split into small time steps. An application of a time step generates a new iPEPS with a bond dimension kkk times the original one. The new iPEPS does not make optimal use of its enlarged bond dimension kDkDkD; hence, in principle, it can be represented accurately by a more compact Ansatz, preferably with the original DDD. In this work we show how the more compact iPEPS can be optimized variationally to maximize its overlap with the new iPEPS. To compute the overlap we use the corner-transfer-matrix renormalization group. By simulating sudden quench of the transverse field in the 2D quantum Ising model with the proposed algorithm, we provide a proof of principle that real-time evolution can be simulated with iPEPS. A similar proof is provided with the same model for imaginary-time evolution of purification of its thermal states.
An infinite projected entangled pair state (iPEPS) is a tensor network ansatz to represent a quantum state on an infinite 2D lattice whose accuracy is controlled by the bond dimension DDD. Its real, Lindbladian, or imaginary time evolution can be split into small time steps. Every time step generates a new iPEPS with an enlarged bond dimension ${D}^{\ensuremath{'}}>D$, which is approximated by an iPEPS with the original DDD. In P. Czarnik and J. Dziarmaga, Phys. Rev. B 98, 045110 (2018), an algorithm was introduced to optimize the approximate iPEPS by maximizing directly its fidelity to the one with the enlarged bond dimension ${D}^{\ensuremath{'}}$. In this paper, we implement a more efficient optimization employing a local estimator of the fidelity. For imaginary time evolution of a thermal state's purification, we also consider using unitary disentangling gates acting on ancillas to reduce the required DDD. We test the algorithm simulating Lindbladian evolution and unitary evolution after a sudden quench of transverse field hx{h}_{x}hx​ in the 2D quantum Ising model. Furthermore, we simulate thermal states of this model and estimate the critical temperature with good accuracy: 0.10.1%0.1 for hx=2.5{h}_{x}=2.5hx​=2.5 and 0.50.5%0.5 for the more challenging case of hx=2.9{h}_{x}=2.9hx​=2.9 close to the quantum critical point at hx=3.04438(2){h}_{x}=3.04438(2)hx​=3.04438(2).
An algorithm for imaginary time evolution of a fermionic projected entangled pair state with ancillas from infinite temperature down to a finite temperature state is presented. As a benchmark application, it is applied to spinless fermions hopping on a square lattice subject to ppp-wave pairing interactions. With a tiny bias it allows one to evolve the system across a high-temperature continuous symmetry-breaking phase transition.
The projected entangled pair state (PEPS) ansatz can represent a thermal state in a strongly correlated system. We introduce a variational algorithm to optimize this tensor network whose essential ingredient is an auxiliary tree tensor network (TTN). Since the full tensor environment is taken into account, with increasing bond dimension the PEPS-TTN ansatz provides the exact Gibbs state. Our presentation opens with a 1D version for a matrix product state (MPS-TTN) and then generalizes to PEPS-TTN in 2D. Benchmark results in the quantum Ising model are presented.