Abstract

Many applications of quantum simulation require to prepare and then characterize quantum states by performing an efficient partial tomography to estimate observables corresponding to $k$-body reduced density matrices ($k$-RDMs). For instance, variational algorithms for the quantum simulation of chemistry usually require that one measure the fermionic 2-RDM. While such marginals provide a tractable description of quantum states from which many important properties can be computed, their determination often requires a prohibitively large number of circuit repetitions. Here we describe a method by which all elements of $k$-body qubit RDMs acting on $N$ qubits can be directly measured with a number of circuits scaling as ${\cal O}(3^{k} \log^{k-1}\! N)$, an exponential improvement in $N$ over prior art. Next, we show that if one is able to implement a linear depth circuit on a linear array prior to measurement, then one can directly measure all elements of the fermionic 2-RDM using only ${\cal O}(N^2)$ circuits. We prove that this result is asymptotically optimal, thus establishing an exponential separation between the number of circuits required to directly measure all elements of qubit versus fermion RDMs. We further demonstrate a technique to estimate the expectation value of any linear combination of fermionic 2-RDM elements using ${\cal O}(N^4 / \omega)$ circuits, each with only ${\cal O}(\omega)$ gates on a linear array where $\omega \leq N$ is a free parameter. We expect these results will improve the viability of many proposals for near-term quantum simulation.

Highlights

  • The advent of variational methods, most notably the variational quantum eigensolver [1,2], inspires hope that useful contributions to our understanding of strongly correlated physical and chemical systems might be achievable in pre-error-corrected quantum devices [3]

  • We provide schemes for the estimation of fermionic and qubit k-body reduced density matrices (k-RDMs) that minimize the number of unique measurement circuits required, significantly decreasing the time required for partial state tomography over prior art

  • Experimental quantum devices are already reaching the stage where the time required for partial state tomography is prohibitive without optimized scheduling of measurements

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Summary

INTRODUCTION

The advent of variational methods, most notably the variational quantum eigensolver [1,2], inspires hope that useful contributions to our understanding of strongly correlated physical and chemical systems might be achievable in pre-error-corrected quantum devices [3]. The commutation relations between local qubit or local fermionic operators has significant regularity not utilized in naive graph-theoretic algorithms Leveraging this regularity is critical to optimizing and proving bounds on the difficulty of tomography of quantum states. We provide schemes for the estimation of fermionic and qubit k-RDMs that minimize the number of unique measurement circuits required, significantly decreasing the time required for partial state tomography over prior art. We detail an alternative scheme to measure arbitrary linear combinations of fermionic k-RDM elements based on finding large sets of anticommuting operators This scheme requires OðN4=ωÞ measurements but has a measurement circuit gate count of only OðωÞ on a linear array for a free parameter ω < N.

BACKGROUND
NEAR-OPTIMAL MEASUREMENT SCHEMES FOR LOCAL QUBIT AND FERMION OPERATORS
MEASURING ANTICOMMUTING LINEAR COMBINATIONS OF LOCAL
CONCLUSION
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