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This work focuses on learning non-canonical Hamiltonian dynamics from data, where long-term predictions require the preservation of structure both in the learned model and in numerical schemes. Previous research focused on either facet,…

Machine Learning · Computer Science 2025-10-03 Clémentine Courtès , Emmanuel Franck , Michael Kraus , Laurent Navoret , Léopold Trémant

In this work we combine two distinct machine learning methodologies, sequential Monte Carlo and Bayesian experimental design, and apply them to the problem of inferring the dynamical parameters of a quantum system. We design the algorithm…

Quantum Physics · Physics 2012-10-10 Christopher E. Granade , Christopher Ferrie , Nathan Wiebe , D. G. Cory

We propose a quantum algorithm for inferring the molecular nuclear spin Hamiltonian from time-resolved measurements of spin-spin correlators, which can be obtained via nuclear magnetic resonance (NMR). We focus on learning the anisotropic…

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.…

In this paper, we present a proof-of-concept quantum algorithm for simulating time-dependent Hamiltonian evolution by reducing the problem to simulating a time-independent Hamiltonian in a larger space using a discrete clock Hamiltonian…

Quantum Physics · Physics 2025-07-28 Zecheng Li , Chunhao Wang

This paper presents a method for learning Hamiltonian dynamics from a limited set of data points. The Hamiltonian vector field is found by regularized optimization over a reproducing kernel Hilbert space of vector fields that are inherently…

Robotics · Computer Science 2024-11-05 Torbjørn Smith , Olav Egeland

Machine learning methods are widely used in the natural sciences to model and predict physical systems from observation data. Yet, they are often used as poorly understood "black boxes," disregarding existing mathematical structure and…

Machine Learning · Computer Science 2023-10-24 Marco David , Florian Méhats

We study the problem of learning Hamiltonians $H$ that are $s$-sparse in the Pauli basis, given access to their time evolution. Although Hamiltonian learning has been extensively investigated, two issues recur in much of the existing…

We consider the simulation of the dynamics of one nonlocal Hamiltonian by another, allowing arbitrary local resources but no entanglement nor classical communication. We characterize notions of simulation, and proceed to focus on…

Quantum Physics · Physics 2009-11-07 C. H. Bennett , J. I. Cirac , M. S. Leifer , D. W. Leung , N. Linden , S. Popescu , G. Vidal

In this article we study the possibilities of recovering the structure of port-Hamiltonian systems starting from ``unlabelled'' ordinary differential equations describing mechanical systems. The algorithm we suggest solves the problem in…

Computational Engineering, Finance, and Science · Computer Science 2023-04-26 Vladimir Salnikov , Antoine Falaize , Daria Loziienko

The exponential speedups promised by Hamiltonian simulation on a quantum computer depends crucially on structure in both the Hamiltonian $\hat{H}$, and the quantum circuit $\hat{U}$ that encodes its description. In the quest to better…

Quantum Physics · Physics 2017-07-19 Guang Hao Low , Isaac L. Chuang

We explore the use of Physics Informed Neural Networks to analyse nonlinear Hamiltonian Dynamical Systems with a first integral of motion. In this work, we propose an architecture which combines existing Hamiltonian Neural Network…

Machine Learning · Computer Science 2023-08-09 Vedanta Thapar

We consider the problem of learning an interpretable potential energy function from a Hamiltonian system's trajectories. We address this problem for classical, separable Hamiltonian systems. Our approach first constructs a neural network…

Machine Learning · Computer Science 2019-07-30 Harish S. Bhat

In this work, we study the problems of certifying and learning quantum Ising Hamiltonians. Our main contributions are as follows: Certification of Ising Hamiltonians. We show that certifying an Ising Hamiltonian in normalized Frobenius norm…

Identifying unknown Hamiltonians from their quantum dynamics is a pivotal challenge in quantum technologies. In this paper, we introduce Hamiltonian recognition, a framework that bridges quantum hypothesis testing and quantum metrology,…

Quantum Physics · Physics 2026-02-26 Chengkai Zhu , Shuyu He , Yu-Ao Chen , Lei Zhang , Xin Wang

Learning a Bayesian network structure from data is an NP-hard problem and thus exact algorithms are feasible only for small data sets. Therefore, network structures for larger networks are usually learned with various heuristics. Another…

Machine Learning · Computer Science 2012-10-19 Teppo Niinimaki , Pekka Parviainen

We introduce a novel data-driven approach aimed at designing high-quality shape deformations based on a coarse localized input signal. Unlike previous data-driven methods that require a global shape encoding, we observe that…

Graphics · Computer Science 2024-10-14 Ramana Sundararaman , Nicolas Donati , Simone Melzi , Etienne Corman , Maks Ovsjanikov

In this paper we propose a systematic method to solve the inverse dynamical problem for a quantum system governed by the von Neumann equation: to find a class of Hamiltonians reproducing a prescribed time evolution of a pure or mixed state…

Quantum Physics · Physics 2013-07-09 J Bernatska , A Messina

Even though neural networks enjoy widespread use, they still struggle to learn the basic laws of physics. How might we endow them with better inductive biases? In this paper, we draw inspiration from Hamiltonian mechanics to train models…

Neural and Evolutionary Computing · Computer Science 2019-09-06 Sam Greydanus , Misko Dzamba , Jason Yosinski

The past few years have witnessed an increased interest in learning Hamiltonian dynamics in deep learning frameworks. As an inductive bias based on physical laws, Hamiltonian dynamics endow neural networks with accurate long-term…

Machine Learning · Computer Science 2022-03-02 Zhijie Chen , Mingquan Feng , Junchi Yan , Hongyuan Zha
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