Machine learning approach to reconstruct density matrices from quantum marginals

Abstract In this work, we propose a machine learning (ML)-based approach to address a specific aspect of the Quantum Marginal Problem: reconstructing a global density matrix compatible with a given set of quantum marginals. Our method integrates a quantum marginal imposition technique with convolutional denoising autoencoders. The loss function is carefully designed to enforce essential physical constraints, including Hermiticity, positivity, and normalization. Through extensive numerical simulations, we demonstrate the effectiveness of our approach, achieving high success rates and accuracy. Furthermore, we show that, in many cases, our model offers a faster alternative to state-of-the-art semidefinite programming solvers without compromising solution quality. These results highlight the potential of ML techniques for solving complex problems in quantum mechanics.

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Publication Details

Journal
Machine Learning Science and Technology
Published
2025-06-13
DOI
https://doi.org/10.1088/2632-2153/ade48d
Primary Topic
Machine Learning in Materials Science
Type
article
Field-Weighted Citation Impact
0.00

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article

Machine learning approach to reconstruct density matrices from quantum marginals

Daniel Uzcátegui Contreras, A. Delgado, Sebastián Niklitschek, Antônio José Teixeira Guerra
Machine Learning Science and Technology
Machine Learning in Materials Science
article

Machine learning approach to reconstruct density matrices from quantum marginals

Daniel Uzcátegui Contreras, A. Delgado, Sebastián Niklitschek, Antônio José Teixeira Guerra
article en

Abstract

Abstract In this work, we propose a machine learning (ML)-based approach to address a specific aspect of the Quantum Marginal Problem: reconstructing a global density matrix compatible with a given set of quantum marginals. Our method integrates a quantum marginal imposition technique with convolutional denoising autoencoders. The loss function is carefully designed to enforce essential physical constraints, including Hermiticity, positivity, and normalization. Through extensive numerical simulations, we demonstrate the effectiveness of our approach, achieving high success rates and accuracy. Furthermore, we show that, in many cases, our model offers a faster alternative to state-of-the-art semidefinite programming solvers without compromising solution quality. These results highlight the potential of ML techniques for solving complex problems in quantum mechanics.

Machine Learning Science and TechnologyVol. 6(2)
University of Concepción (CL), Millennium Science Initiative (CL)
Fondo Nacional de Desarrollo Científico y Tecnológico
Openalex Percentile: Top 91%
Machine Learning in Materials Science
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Machine learning approach to reconstruct density matrices from quantum marginals — Daniel Uzcátegui Contreras, A. Delgado, et al. · Machine Learning Science and Technology (2025) | TGRS Research Map | TGRS