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IEEE International Conference on Acoustics Speech and Signal Processing

The Role of Initial Entanglement in Adaptive Gibbs State Preparation on Quantum Computers

Sophia E. Economou, Ada Warren, Edwin Barnes

Published May 5, 2023• 2 citations
Publisher

Abstract

Sampling from distributions is an important capability for a range of tasks in science and engineering, including in machine learning applications. Quantum computers hold promise for the capability of sampling from distributions that are hard to sample from with usual (classical) computers. We have recently introduced an adaptive quantum variational algorithm for Gibbs state preparation, a state that can be sampled to yield a thermal (or Gibbs) distribution. This has applications in statistical physics, stochastic processes, and optimization. Here we explore the role of the initial quantum correlations (i.e., entanglement) built into the ‘data’ quantum bits (those that will be sampled) and the ancilla quantum bits (those that assist in preparing the Gibbs state) in the run-time of the adaptive state-preparation algorithm. Based on our simulations, we conclude that certain types of entangled states perform better for Ising Hamiltonians, while others are more appropriate for XY Hamiltonians. We also show that both perform well if multiple operators are added at each iteration through the ‘TETRIS-ADAPT’ technique.

DOI
10.1109/icassp49357.2023.10094697

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Sampling from distributions is an important capability for a range of tasks in science and engineering, including in machine learning applications. Quantum computers hold promise for the capability of sampling from distributions that are hard to sample from with usual (classical) computers. We have recently introduced an adaptive quantum variational algorithm for Gibbs state preparation, a state that can be sampled to yield a thermal (or Gibbs) distribution. This has applications in statistical physics, stochastic processes, and optimization. Here we explore the role of the initial quantum correlations (i.e., entanglement) built into the ‘data’ quantum bits (those that will be sampled) and the ancilla quantum bits (those that assist in preparing the Gibbs state) in the run-time of the adaptive state-preparation algorithm. Based on our simulations, we conclude that certain types of entangled states perform better for Ising Hamiltonians, while others are more appropriate for XY Hamiltonians. We also show that both perform well if multiple operators are added at each iteration through the ‘TETRIS-ADAPT’ technique.
The preparation of Gibbs thermal states is an important task in quantum computation with applications in quantum simulation, quantum optimization, and quantum machine learning. However, many algorithms for preparing Gibbs states rely on quantum subroutines which are difficult to implement on near-term hardware. Here, we address this by (i) introducing an objective function that, unlike the free energy, is easily measured, and (ii) using dynamically generated, problem-tailored ansätze. This allows for arbitrarily accurate Gibbs state preparation using low-depth circuits. To verify the effectiveness of our approach, we numerically demonstrate that our algorithm can prepare high-fidelity Gibbs states across a broad range of temperatures and for a variety of Hamiltonians.
Gibbs state preparation has emerged as a potential avenue for quantum advantage in the study of physical systems. Although there is known advantage for computing local properties of worst-case Gibbs states, recent results suggest a different picture for average-case local systems: at temperatures where their Gibbs states can be efficiently prepared quantumly, quasi-polynomial time classical algorithms can also compute local expectation values. Yet this leaves open the possibility of an advantage under a stronger notion of simulation: sampling. Gibbs sampling underlies Boltzmann machine-based quantum learning algorithms and quantum supremacy proposals, but its classical average-case complexity for physically relevant models remains unresolved. Here, we give strong evidence against an exponential quantum advantage in Gibbs sampling for an ensemble of local systems known as the quantum ppp-spin model. We describe a classical algorithm for sampling from the Gibbs state to any polynomially small error in total variation distance. Our algorithm is based on a meta-algorithm known as algorithmic stochastic localization (ASL). Our main technical result is a generalized convergence theorem for ASL which reduces approximate sampling from any distribution on the hypercube to estimating the mean of a related "tilted distribution" to sufficiently low additive error. We then extend known quasi-polynomial time algorithms for computing local expectation values of a related disordered model to compute these "tilted means" for the quantum ppp-spin model. Finally, we give a non-rigorous physics argument that this mean-estimation algorithm works down to the spin glass transition temperature. As efficient quantum algorithms also fail at this transition, this suggests they cannot Gibbs sample the quantum ppp-spin model at temperatures below that for which classical algorithms are also (almost) efficient.
Preparation of Gibbs distributions is an important task for quantum computation. It is a necessary first step in some types of quantum simulations and further is essential for quantum algorithms such as quantum Boltzmann training. Despite this, most methods for preparing thermal states are impractical to implement on near-term quantum computers because of the memory overheads required. Here we present a variational approach to preparing Gibbs states that is based on minimizing the free energy of a quantum system. The key insight that makes this practical is the use of Fourier series approximations to the logarithm that allows the entropy component of the free-energy to be estimated through a sequence of simpler measurements that can be combined together using classical post processing. We further show that this approach is efficient for generating high-temperature Gibbs states, within constant error, if the initial guess for the variational parameters for the programmable quantum circuit are sufficiently close to a global optima. Finally, we examine the procedure numerically and show the viability of our approach for five-qubit Hamiltonians using Trotterized adiabatic state preparation as an ansatz.
The simulation of quantum physical systems is expected to be an important application for quantum computers. The work presented in this dissertation aims to improve the resource requirements of quantum computers for solving simulation problems, by providing both novel quantum algorithms and improved implementations of existing ones. I present three main results that cover diverse aspects of simulation including equilibrium physics, the preparation of useful quantum states, and simulations based on classical stochastic processes. The results rely on established quantum algorithms and other recent techniques which I review. My first original contribution is a new quantum algorithm to sample from the thermal Gibbs state of quantum Hamiltonians. The complexity of this algorithm has an exponentially improved dependence on precision compared to an earlier quantum algorithm, and also provides polynomial improvements in other parameters. My second contribution is an improved algorithm to implement reflections about the eigenstates of unitary operators and Hamiltonians, an operation that can be used to prepare ground states of many-body Hamiltonians by quantum amplitude amplification. The improved algorithm for implementing reflections significantly reduces the number of ancilla qubits required over earlier implementations. The improvement relies in part on a novel quantum algorithm for efficiently preparing states with Gaussian-like amplitudes, which may have broad applications. I also prove a lower bound for implementing reflections, which shows that our algorithm is almost optimal. My third and final contribution regards quantum algorithms for classical stochastic processes, which are of importance in statistical physics. I present a quantum algorithm that estimates the average running time of a stochastic process, and provides a quadratic speed-up over a comparable classical algorithm.
Efficient sampling from a classical Gibbs distribution is an important computational problem with applications ranging from statistical physics over Monte Carlo and optimization algorithms to machine learning. We introduce a family of quantum algorithms that provide unbiased samples by preparing a state encoding the entire Gibbs distribution. We show that this approach leads to a speedup over a classical Markov chain algorithm for several examples, including the Ising model and sampling from weighted independent sets of two different graphs. Our approach connects computational complexity with phase transitions, providing a physical interpretation of quantum speedup. Moreover, it opens the door to exploring potentially useful sampling algorithms on near-term quantum devices, as the algorithm for sampling from independent sets on certain graphs can be naturally implemented using Rydberg atom arrays.
Gibbs states (i.e., thermal states) can be used for several applications such as quantum simulation, quantum machine learning, quantum optimization, and the study of open quantum systems. Moreover, semi-definite programming, combinatorial optimization problems, and training quantum Boltzmann machines can all be addressed by sampling from well-prepared Gibbs states. With that, however, comes the fact that preparing and sampling from Gibbs states on a quantum computer are notoriously difficult tasks. Such tasks can require large overhead in resources and/or calibration even in the simplest of cases, as well as the fact that the implementation might be limited to only a specific set of systems. We propose a method based on sampling from a quasi-distribution consisting of tensor products of mixed states on local clusters, i.e., expanding the full Gibbs state into a sum of products of local “Gibbs-cumulant” type states easier to implement and sample from on quantum hardware. We begin with presenting results for 4-spin linear chains with XY spin interactions, for which we obtain the Z Z dynamical spin-spin correlation functions and dynamical structure factor. We also present the results of measuring the specific heat of the 8-spin chain Gibbs state ρ 8 .