Shallow Electronic State Preparation for Quantum Chemistry with Quantum Monte Carlo Pre-Selection

Fuente: arXiv
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Autores principales: Welling, Eline, Cadi-Tazi, Lila, Thom, Alex J. W., Filip, Maria-Andreea
Formato: Preprint
Publicado: 2026
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author Welling, Eline
Cadi-Tazi, Lila
Thom, Alex J. W.
Filip, Maria-Andreea
author_facet Welling, Eline
Cadi-Tazi, Lila
Thom, Alex J. W.
Filip, Maria-Andreea
contents Quantum computers hold great promise for molecular simulation, but noise remains a fundamental obstacle. We introduce a Quantum Monte Carlo (QMC) pre-screening procedure that constructs compact, physically motivated Givens rotation ansätze tailored to realistic quantum hardware. By identifying the most important wavefunction contributions early in a QMC simulation, we build circuits that are shallower that conventional alternatives while preserving number symmetry. Benchmarked on Quantinuum System Model H1, QMC-prescreened circuits outperform more complex ansätze under realistic noise conditions. The method offers a practical path toward chemical accuracy on quantum devices, by providing an adjustable trade-off between expressivity and circuit depth to generate shallow circuits suited to current high-noise devices, as well as deeper, more expressive circuits that can be deployed on future lower-noise devices.
format Preprint
id arxiv_https___arxiv_org_abs_2605_31139
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Shallow Electronic State Preparation for Quantum Chemistry with Quantum Monte Carlo Pre-Selection
Welling, Eline
Cadi-Tazi, Lila
Thom, Alex J. W.
Filip, Maria-Andreea
Quantum Physics
Chemical Physics
Quantum computers hold great promise for molecular simulation, but noise remains a fundamental obstacle. We introduce a Quantum Monte Carlo (QMC) pre-screening procedure that constructs compact, physically motivated Givens rotation ansätze tailored to realistic quantum hardware. By identifying the most important wavefunction contributions early in a QMC simulation, we build circuits that are shallower that conventional alternatives while preserving number symmetry. Benchmarked on Quantinuum System Model H1, QMC-prescreened circuits outperform more complex ansätze under realistic noise conditions. The method offers a practical path toward chemical accuracy on quantum devices, by providing an adjustable trade-off between expressivity and circuit depth to generate shallow circuits suited to current high-noise devices, as well as deeper, more expressive circuits that can be deployed on future lower-noise devices.
title Shallow Electronic State Preparation for Quantum Chemistry with Quantum Monte Carlo Pre-Selection
topic Quantum Physics
Chemical Physics
url https://arxiv.org/abs/2605.31139