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Hamiltonian systems with multiple timescales arise in molecular dynamics, classical mechanics, and theoretical physics. Long-time numerical integration of such systems requires resolving fast dynamics with very small time steps, which…

Numerical Analysis · Mathematics 2025-10-30 Rui Fang , Richard Tsai

Physics-informed deep learning has achieved remarkable progress by embedding geometric priors, such as Hamiltonian symmetries and variational principles, into neural networks, enabling structure-preserving models that extrapolate with high…

Robotics · Computer Science 2026-03-06 Aristotelis Papatheodorou , Pranav Vaidhyanathan , Natalia Ares , Ioannis Havoutis

We present a physical interpretation of machine learning functions, opening up the possibility to control properties of statistical systems via the inclusion of these functions in Hamiltonians. In particular, we include the predictive…

High Energy Physics - Lattice · Physics 2021-02-17 Dimitrios Bachtis , Gert Aarts , Biagio Lucini

This paper presents a novel credit scoring approach using neural networks to address class imbalance and out-of-time prediction challenges. We develop a specific optimizer and loss function inspired by Hamiltonian mechanics that better…

Machine Learning · Computer Science 2025-03-13 Javier Marín

Hidden Markov models (HMMs) and partially observable Markov decision processes (POMDPs) form a useful tool for modeling dynamical systems. They are particularly useful for representing environments such as road networks and office…

Artificial Intelligence · Computer Science 2013-01-30 Hagit Shatkay

We train a small message-passing graph neural network to predict Hamiltonian cycles on Erd\H{o}s-R\'enyi random graphs in a critical regime. It outperforms existing hand-crafted heuristics after about 2.5 hours of training on a single GPU.…

Machine Learning · Computer Science 2023-06-13 Filip Bosnić , Mile Šikić

Neural networks are discrete entities: subdivided into discrete layers and parametrized by weights which are iteratively optimized via difference equations. Recent work proposes networks with layer outputs which are no longer quantized but…

Neural and Evolutionary Computing · Computer Science 2019-09-09 Stefano Massaroli , Michael Poli , Federico Califano , Angela Faragasso , Jinkyoo Park , Atsushi Yamashita , Hajime Asama

This paper investigates the problem of data-driven modeling of port-Hamiltonian systems while preserving their intrinsic Hamiltonian structure and stability properties. We propose a novel neural-network-based port-Hamiltonian modeling…

Systems and Control · Electrical Eng. & Systems 2026-04-16 Binh Nguyen , Nam T. Nguyen , Truong X. Nghiem

This work introduces a new framework integrating port-Hamiltonian systems (PHS) and neural network architectures. This framework bridges the gap between deterministic and stochastic modeling of complex dynamical systems. We introduce new…

Mathematical Physics · Physics 2025-09-09 Luca Di Persio , Matthias Ehrhardt , Youness Outaleb , Sofia Rizzotto

Reasoning about the physical world requires models that are endowed with the right inductive biases to learn the underlying dynamics. Recent works improve generalization for predicting trajectories by learning the Hamiltonian or Lagrangian…

Machine Learning · Computer Science 2020-10-27 Marc Finzi , Ke Alexander Wang , Andrew Gordon Wilson

Data-driven modeling of physical systems often relies on learning both positions and momenta to accurately capture Hamiltonian dynamics. However, in many practical scenarios, only position measurements are readily available. In this work,…

Computational Physics · Physics 2025-05-06 Ruichen Xu , Zongyu Wu , Luoyao Chen , Georgios Kementzidis , Siyao Wang , Haochun Wang , Yiwei Shi , Yuefan Deng

Neural networks that synergistically integrate data and physical laws offer great promise in modeling dynamical systems. However, iterative gradient-based optimization of network parameters is often computationally expensive and suffers…

Machine Learning · Computer Science 2026-04-16 Atamert Rahma , Chinmay Datar , Felix Dietrich

Urban transportation systems face increasing resilience challenges from extreme weather events, but current assessment methods rely on surface-level recovery indicators that miss hidden structural damage. Existing approaches cannot…

Machine Learning · Computer Science 2025-12-04 Xuhui Lin , Qiuchen Lu

Hybrid optical neural networks (HONNs) offload some electronic computation to optical preprocessors to achieve low-power and fast training and inference phases in machine learning tasks. Our contribution to the development of HONNs is a…

Optics · Physics 2025-10-07 Altai Perry , Luat Vuong

We consider the problem of learning the Hamiltonian of a quantum system from estimates of Gibbs-state expectation values. Various methods for achieving this task were proposed recently, both from a practical and theoretical point of view.…

Quantum Physics · Physics 2024-10-31 Adam Artymowicz , Hamza Fawzi , Omar Fawzi , Samuel O. Scalet

Value function based reinforcement learning (RL) algorithms, for example, $Q$-learning, learn optimal policies from datasets of actions, rewards, and state transitions. However, when the underlying state transition dynamics are stochastic…

Machine Learning · Computer Science 2022-03-29 Udari Madhushani , Biswadip Dey , Naomi Ehrich Leonard , Amit Chakraborty

We develop a method to learn physical systems from data that employs feedforward neural networks and whose predictions comply with the first and second principles of thermodynamics. The method employs a minimum amount of data by enforcing…

Machine Learning · Computer Science 2020-11-16 Quercus Hernández , Alberto Badias , David Gonzalez , Francisco Chinesta , Elias Cueto

We introduce a generalizable framework for learning to identify effective Hamiltonians directly from experimental data in solid-state quantum systems. Our approach is based on a physics-informed neural network architecture that embeds…

Mesoscale and Nanoscale Physics · Physics 2026-03-04 Jarosław Pawłowski , Mateusz Krawczyk

Symplectic numerical methods have become a widely-used choice for the accurate simulation of Hamiltonian systems in various fields, including celestial mechanics, molecular dynamics and robotics. Even though their characteristics are…

Numerical Analysis · Mathematics 2025-06-27 Donát M. Takács , Tamás Fülöp

Optimization of high-dimensional black-box functions is an extremely challenging problem. While Bayesian optimization has emerged as a popular approach for optimizing black-box functions, its applicability has been limited to…

Machine Learning · Statistics 2018-08-06 Zi Wang , Chengtao Li , Stefanie Jegelka , Pushmeet Kohli
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