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arXiv:2110.13584

Phase Estimation of Local Hamiltonians on NISQ Hardware

Laura Clinton, Johannes Bausch, Joel Klassen, Toby S. Cubitt

Published Oct 26, 2021• 2 citations
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Abstract

In this work we investigate a binned version of Quantum Phase Estimation (QPE) set out by [Somma 2019] and known as the Quantum Eigenvalue Estimation Problem (QEEP). Specifically, we determine whether the circuit decomposition techniques we set out in previous work, [Clinton et al 2020], can improve the performance of QEEP in the NISQ regime. To this end we adopt a physically motivated abstraction of NISQ device capabilities as in [Clinton et al 2020]. Within this framework, we find that our techniques reduce the threshold at which it becomes possible to perform the minimum two-bin instance of this algorithm by an order of magnitude. This is for the specific example of a two dimensional spin Fermi-Hubbard model. For example, given a $10\%$ acceptable error on a $3\times 3$ spin Fermi-Hubbard model, with a depolarizing noise rate of $10^{-6}$, we find that the phase estimation protocol of [Somma 2019] could be performed with a bin width of approximately $1/9$ the total spectral range at the circuit depth where traditional gate synthesis methods would yield a bin width that covers the entire spectral range. We explore possible modifications to this protocol and propose an application, which we call Randomized Quantum Eigenvalue Estimation Problem (rQeep). rQeep outputs estimates on the fraction of eigenvalues which lie within randomly chosen bins and upper bounds the total deviation of these estimates from the true values. One use case we envision for this algorithm is resolving density of states features of local Hamiltonians, such as spectral gaps.

DOI
10.48550/arxiv.2110.13584

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In this work we investigate a binned version of Quantum Phase Estimation (QPE) set out by [Somma 2019] and known as the Quantum Eigenvalue Estimation Problem (QEEP). Specifically, we determine whether the circuit decomposition techniques we set out in previous work, [Clinton et al 2020], can improve the performance of QEEP in the NISQ regime. To this end we adopt a physically motivated abstraction of NISQ device capabilities as in [Clinton et al 2020]. Within this framework, we find that our techniques reduce the threshold at which it becomes possible to perform the minimum two-bin instance of this algorithm by an order of magnitude. This is for the specific example of a two dimensional spin Fermi-Hubbard model. For example, given a 10%10\%10% acceptable error on a 3×33\times 33×3 spin Fermi-Hubbard model, with a depolarizing noise rate of 10−610^{-6}10−6, we find that the phase estimation protocol of [Somma 2019] could be performed with a bin width of approximately 1/91/91/9 the total spectral range at the circuit depth where traditional gate synthesis methods would yield a bin width that covers the entire spectral range. We explore possible modifications to this protocol and propose an application, which we call Randomized Quantum Eigenvalue Estimation Problem (rQeep). rQeep outputs estimates on the fraction of eigenvalues which lie within randomly chosen bins and upper bounds the total deviation of these estimates from the true values. One use case we envision for this algorithm is resolving density of states features of local Hamiltonians, such as spectral gaps.
Abstract In this work we investigate a binned version of quantum phase estimation (QPE) set out by Somma (2019 New J. Phys. 21 123025) and known as the quantum eigenvalue estimation problem (QEEP). Specifically, we determine whether the circuit decomposition techniques we set out in previous work, Clinton et al (2021 Nat. Commun. 12 1–10), can improve the performance of QEEP in the noisy intermediate scale quantum (NISQ) regime. To this end we adopt a physically motivated abstraction of NISQ device capabilities as in Clinton et al (2021 Nat. Commun. 12 1–10). Within this framework, we find that our techniques reduce the threshold at which it becomes possible to perform the minimum two-bin instance of this algorithm by an order of magnitude. This is for the specific example of a two dimensional spin Fermi-Hubbard model. For example, we estimate that the depolarizing single qubit error rate required to implement a minimum two bin example of QEEP—with a 5 × 5 Fermi-Hubbard model and up to a precision of 10 % —can be reduced from 10−7 to 10−5. We explore possible modifications to this protocol and propose an application, which we dub randomized quantum eigenvalue estimation problem (rQEEP). rQEEP outputs estimates on the fraction of eigenvalues which lie within randomly chosen bins and upper bounds the total deviation of these estimates from the true values. One use case we envision for this algorithm is resolving density of states features of local Hamiltonians.
The Quantum Phase Difference Estimation (QPDE) algorithm, as an extension of the Quantum Phase Estimation (QPE), is a quantum algorithm designed to compute the differences of two eigenvalues of a unitary operator by exploiting the quantum superposition of two eigenstates. Unlike QPE, QPDE is free of controlled-unitary operations, and is suitable for calculations on noisy intermediate-scale quantum (NISQ) devices. We present the implementation and verification of a novel early fault-tolerant QPDE algorithm for determining energy gaps across diverse spin system configurations using NISQ devices. The algorithm is applied to the systems described by two and three-spin Heisenberg Hamiltonians with different geometric arrangements and coupling strengths, including symmetric, asymmetric, spin-frustrated, and non-frustrated configurations. By leveraging the match gate-like structure of the time evolution operator of Heisenberg Hamiltonian, we achieve constant-depth quantum circuits suitable for NISQ hardware implementation. Our results on IBM quantum processors show remarkable accuracy ranging from 85\% to 93\%, demonstrating excellent agreement with classical calculations even in the presence of hardware noise. The methodology incorporates sophisticated quantum noise suppression techniques, including Pauli Twirling and Dynamical Decoupling, and employs an adaptive framework. Our findings demonstrate the practical viability of the QPDE algorithm for quantum many-body simulations on current NISQ hardware, establishing a robust framework for future applications.
Abstract Quantum phase estimation (QPE) is a fundamental tool in quantum computing, facilitating efficient simulations of complex problems in quantum chemistry and materials science. While most phase estimation algorithms are deterministic, recent advancements indicate that incorporating randomness can enhance performance. This study introduces a framework for randomized QPE that merges the benefits of randomized compilation with phase estimation algorithms based on quantum signal processing. Our proposed algorithms effectively reduce circuit depths by eliminating the need for precise Hamiltonian time evolution, making them advantageous for digital quantum computers estimating the eigenvalue and eigenvector properties of Hamiltonians. Notably, our findings show that the quantum stochastic drift protocol (qDRIFT)-based randomized algorithm surpasses the original phase estimation with qDRIFT, especially in scaling inverse failure probabilities. We also establish that a circuit depth of O ( log ⁡ ( M ) ) suffices for estimating M distinct observables. The protocol is executed through multiple iterations of the randomized algorithms combined with classical shadow techniques. Overall, our framework retains many advantages of the randomized compilation technique, making it a compelling solution for challenges in quantum chemistry.
We present several refinements and extensions of the statistical quantum phase estimation (SQPE) framework to address some of its key practical limitations, improving its applicability to realistic cases. Recently, a family of statistical approaches for QPE have been proposed where each run uses only a few ancillae and shorter circuits than standard QPE and thus is better suited for early fault-tolerant quantum computers that are qubit-and depth-limited. SQPE method within that family estimates the cumulative distribution function (CDF) associated with spectral density of the Hamiltonian for a given trial state by using its Fourier approximation and then identifies the first jump discontinuity of the CDF to determine the ground state energy (GSE) of the Hamiltonian. It relies on random compilation procedure based on linear combination of unitaries (LCU) decomposition of the Hamiltonian assuming positive Pauli weights and requires a good estimate of lower bound on the overlap between the trial and true ground state, both of which may be difficult to achieve in practice. We address these limitations by generalizing the random compilation procedure for negative Pauli weights and employing a changepoint detection method for determining GSE which does not rely on an estimate of this overlap. We also show that by exploiting symmetry of the Fourier series one can reduce number of circuit runs/samples by a factor of 2x while keeping the GSE estimation accuracy the same. We illustrate these new developments numerically via a quantum simulator in Qiskit.
We develop a phase-estimation method with a distinct feature: its maximal run time (which determines the circuit depth) is δ/ , where is the target precision, and the preconstant δ can be arbitrarily close to 0 as the initial state approaches the target eigenstate.The total cost of the algorithm satisfies the Heisenberg-limited scaling O( -1 ).As a result, our algorithm may significantly reduce the circuit depth for performing phase-estimation tasks on early fault-tolerant quantum computers.The key technique is a simple subroutine called quantum complex exponential least squares (QCELS).Our algorithm can be readily applied to reduce the circuit depth for estimating the ground-state energy of a quantum Hamiltonian, when the overlap between the initial state and the ground state is large.If this initial overlap is small, we can combine our method with the Fourier-filtering method developed in [Lin and Tong, PRX Quantum 3, 010318, 2022], and the resulting algorithm provably reduces the circuit depth in the presence of a large relative overlap compared to .The relative-overlap condition is similar to a spectral-gap assumption but it is aware of the information in the initial state and is therefore applicable to certain Hamiltonians with small spectral gaps.We observe that the circuit depth can be reduced by around 2 orders of magnitude in numerical experiments under various settings.
Quantum phase estimation (QPE) is the workhorse behind any quantum algorithm and a promising method for determining ground state energies of strongly correlated quantum systems. Low-cost QPE techniques make use of circuits which only use a single ancilla qubit, requiring classical post-processing to extract eigenvalue details of the system. We investigate choices for phase estimation for a unitary matrix with low-depth noise-free or noisy circuits, varying both the phase estimation circuits themselves as well as the classical post-processing to determine the eigenvalue phases. We work in the scenario when the input state is not an eigenstate of the unitary matrix. We develop a new post-processing technique to extract eigenvalues from phase estimation data based on a classical time-series (or frequency) analysis and contrast this to an analysis via Bayesian methods. We calculate the variance in estimating single eigenvalues via the time-series analysis analytically, finding that it scales to first order in the number of experiments performed, and to first or second order (depending on the experiment design) in the circuit depth. Numerical simulations confirm this scaling for both estimators. We attempt to compensate for the noise with both classical post-processing techniques, finding good results in the presence of depolarizing noise, but smaller improvements in 9-qubit circuit-level simulations of superconducting qubits aimed at resolving the electronic ground state of a H 4 -molecule.