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Large-scale quantum devices provide insights beyond the reach of classical simulations. However, for a reliable and verifiable quantum simulation, the building blocks of the quantum device require exquisite benchmarking. This benchmarking…

Quantum Physics · Physics 2022-02-16 Agnes Valenti , Guliuxin Jin , Julian Léonard , Sebastian D. Huber , Eliska Greplova

Identifying Hamiltonian of a quantum system is of vital importance for quantum information processing. In this Letter, we realized and benchmarked a quantum Hamiltonian identification algorithm recently proposed [Phys. Rev. Lett.…

Quantum Physics · Physics 2014-10-16 Shi-yao Hou , Hang Li , Gui-Lu Long

Identifying the Hamiltonian of a quantum system from experimental data is considered. General limits on the identifiability of model parameters with limited experimental resources are investigated, and a specific Bayesian estimation…

Quantum Physics · Physics 2019-10-15 S. G. Schirmer , F. C. Langbein

Maximizing the computational utility of near-term quantum processors requires predictive noise models that inform robust, noise-aware compilation and error mitigation. Conventional models often fail to capture the complex error dynamics of…

Quantum Physics · Physics 2026-03-17 Yanjun Ji , Marco Roth , David A. Kreplin , Ilia Polian , Frank K. Wilhelm

Hamiltonian neural networks (HNNs) represent a promising class of physics-informed deep learning methods that utilize Hamiltonian theory as foundational knowledge within neural networks. However, their direct application to engineering…

Machine Learning · Computer Science 2025-02-21 Sarvin Moradi , Gerben I. Beintema , Nick Jaensson , Roland Tóth , Maarten Schoukens

With the explosion of massive, widely available unlabeled data in the past years, finding label and time efficient, robust learning algorithms has become ever more important in theory and in practice. We study the paradigm of active…

Machine Learning · Computer Science 2020-01-17 Max Hopkins , Daniel Kane , Shachar Lovett , Gaurav Mahajan

Advancements in the implementation of quantum hardware have enabled the acquisition of data that are intractable for emulation with classical computers. The integration of classical machine learning (ML) algorithms with these data holds…

Quantum Physics · Physics 2025-01-22 Gyungmin Cho , Dohun Kim

The rapid growth of research in exploiting machine learning to predict chaotic systems has revived a recent interest in Hamiltonian Neural Networks (HNNs) with physical constraints defined by the Hamilton's equations of motion, which…

Machine Learning · Computer Science 2021-06-02 Chen-Di Han , Bryan Glaz , Mulugeta Haile , Ying-Cheng Lai

Quantum computational chemistry holds great promise for simulating molecular systems more efficiently than classical methods by leveraging quantum bits to represent molecular wavefunctions. However, current implementations face significant…

Quantum Physics · Physics 2025-09-10 Weitang Li , Shi-Xin Zhang , Zirui Sheng , Cunxi Gong , Jianpeng Chen , Zhigang Shuai

We formalize and study the Hamiltonian certification problem. Given access to $e^{-\mathrm{i} Ht}$ for an unknown Hamiltonian $H$, the goal of the problem is to determine whether $H$ is $\varepsilon_1$-close to or $\varepsilon_2$-far from a…

Quantum Physics · Physics 2026-05-07 Minbo Gao , Zhengfeng Ji , Qisheng Wang , Wenjun Yu , Qi Zhao

We study the problem of Hamiltonian structure learning from real-time evolution: given the ability to apply $e^{-\mathrm{i} Ht}$ for an unknown local Hamiltonian $H = \sum_{a = 1}^m \lambda_a E_a$ on $n$ qubits, the goal is to recover $H$.…

Quantum Physics · Physics 2026-05-11 Ainesh Bakshi , Allen Liu , Ankur Moitra , Ewin Tang

The application of average Hamiltonian theory (AHT) to magnetic resonance and quantum sensing informs pulse sequence design, for example, by providing efficient approximations of spin dynamics while retaining important physical…

The physics of a closed quantum mechanical system is governed by its Hamiltonian. However, in most practical situations, this Hamiltonian is not precisely known, and ultimately all there is are data obtained from measurements on the system.…

The next generation of advanced materials is tending toward increasingly complex compositions. Synthesizing precise composition is time-consuming and becomes exponentially demanding with increasing compositional complexity. An experienced…

Materials Science · Physics 2024-03-12 Nathan Johnson , Aashwin Ananda Mishra , Apurva Mehta

Quantum machine learning for spin and molecular systems faces critical challenges of scarce labeled data and computationally expensive simulations. To address these limitations, we introduce Hamiltonian-Masked Autoencoding (HMAE), a novel…

Quantum Physics · Physics 2025-10-29 Ibne Farabi Shihab , Sanjeda Akter , Anuj Sharma

One of the key challenges in quantum machine learning is finding relevant machine learning tasks with a provable quantum advantage. A natural candidate for this is learning unknown Hamiltonian dynamics. Here, we tackle the supervised…

Quantum Physics · Physics 2025-06-23 Alice Barthe , Mahtab Yaghubi Rad , Michele Grossi , Vedran Dunjko

Learning the unknown Hamiltonian governing the dynamics of a quantum many-body system is a challenging task. In this manuscript, we propose a possible strategy based on repeated measurements on a single time-dependent state. We prove that…

Quantum Physics · Physics 2023-01-27 Davide Rattacaso , Gianluca Passarelli , Procolo Lucignano

Variational hybrid quantum-classical optimization represents one of the most promising avenue to show the advantage of nowadays noisy intermediate-scale quantum computers in solving hard problems, such as finding the minimum-energy state of…

Quantum Physics · Physics 2020-11-18 Laura Gentini , Alessandro Cuccoli , Stefano Pirandola , Paola Verrucchi , Leonardo Banchi

Quantifying the impacts of air pollution on health and climate relies on key atmospheric particle properties such as toxicity and hygroscopicity. However, these properties typically require complex observational techniques or expensive…

Machine Learning · Computer Science 2026-02-13 Fei Jiang , Jiyang Xia , Junjie Yu , Mingfei Sun , Hugh Coe , David Topping , Dantong Liu , Zhenhui Jessie Li , Zhonghua Zheng

Quantum algorithms on the noisy intermediate-scale quantum (NISQ) devices are expected to simulate quantum systems that are classically intractable to demonstrate quantum advantages. However, the non-negligible gate error on the NISQ…

Quantum Physics · Physics 2021-12-06 Joseph C. Aulicino , Trevor Keen , Bo Peng