Auxiliary-Field Quantum Monte Carlo on Quantum Hardware via Unitary Dilation

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1. Verfasser: Li, Xiantao
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Veröffentlicht: 2026
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author Li, Xiantao
author_facet Li, Xiantao
contents We present near-term quantum algorithms for auxiliary-field quantum Monte Carlo (AFQMC), viewed as imaginary-time projection for ground-state calculation as an ensemble of one-body propagators driven by stochastic fields $Ω$. Starting from the Feynman-Kac formula, we convert each trajectory into a sequence of piecewise-constant one-body generators using stochastic Magnus expansions up to second order, and embed the resulting nonunitary slices into unitaries with a small ancilla overhead. This lifts the projector dynamics to a unitary evolution, enabling coherent circuit execution in the regime $\|Ω\| τ=O(1)$ and reducing the need for frequent mid-circuit measurement. We further derive an equivalent linear-combination-of-unitaries (LCU) form that yields system-only, shallower circuits by trading ancilla cost for additional trajectory sampling. Benchmarks on the Hubbard model verify the accuracy of the dilation and Magnus expansions classically and demonstrate multi-step executions on IBM quantum hardware.
format Preprint
id arxiv_https___arxiv_org_abs_2603_11197
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Auxiliary-Field Quantum Monte Carlo on Quantum Hardware via Unitary Dilation
Li, Xiantao
Quantum Physics
We present near-term quantum algorithms for auxiliary-field quantum Monte Carlo (AFQMC), viewed as imaginary-time projection for ground-state calculation as an ensemble of one-body propagators driven by stochastic fields $Ω$. Starting from the Feynman-Kac formula, we convert each trajectory into a sequence of piecewise-constant one-body generators using stochastic Magnus expansions up to second order, and embed the resulting nonunitary slices into unitaries with a small ancilla overhead. This lifts the projector dynamics to a unitary evolution, enabling coherent circuit execution in the regime $\|Ω\| τ=O(1)$ and reducing the need for frequent mid-circuit measurement. We further derive an equivalent linear-combination-of-unitaries (LCU) form that yields system-only, shallower circuits by trading ancilla cost for additional trajectory sampling. Benchmarks on the Hubbard model verify the accuracy of the dilation and Magnus expansions classically and demonstrate multi-step executions on IBM quantum hardware.
title Auxiliary-Field Quantum Monte Carlo on Quantum Hardware via Unitary Dilation
topic Quantum Physics
url https://arxiv.org/abs/2603.11197