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Dynamical systems provide a comprehensive way to study complex and changing behaviors across various sciences. Many modern systems are too complicated to analyze directly or we do not have access to models, driving significant interest in…

Dynamical Systems · Mathematics 2024-07-10 Matthew J. Colbrook , Igor Mezić , Alexei Stepanenko

Nonlinear spectroscopy employs a series of laser pulses to interrogate dynamics in large interacting many-body systems, and has become a highly successful method for experiments in chemical physics. Current quantum optical experiments…

Quantum Physics · Physics 2016-10-19 Frank Schlawin , Manuel Gessner , Shaul Mukamel , Andreas Buchleitner

Transfer and Koopman operator methods offer a framework for representing complex, nonlinear dynamical systems via linear transformations, enabling a deeper understanding of the underlying dynamics. The spectra of these operators provide…

Dynamical Systems · Mathematics 2026-03-25 Gary Froyland , Kevin Kühl

Molecular dynamics (MD) simulations are a central tool in science and engineering enabling the study of dynamical behavior and the link between microscopic structure and macroscopic function. Their high computational cost, however, has…

Chemical Physics · Physics 2026-01-22 Salman N. Salman , Sergey A. Shteingolts , Ron Levie , Dan Mendels

In this paper we propose a new Koopman operator approach to the decomposition of nonlinear dynamical systems using Koopman Gramians. We introduce the notion of an input-Koopman operator, and show how input-Koopman operators can be used to…

Systems and Control · Computer Science 2017-12-11 Zhiyuan Liu , Soumya Kundu , Lijun Chen , Enoch Yeung

In this paper, we focus on the data-driven discovery of a general second-order particle-based model that contains many state-of-the-art models for modeling the aggregation and collective behavior of interacting agents of similar size and…

Machine Learning · Statistics 2023-11-03 Jinchao Feng , Charles Kulick , Sui Tang

Coarse-graining has become an area of tremendous importance within many different research fields. For molecular simulation, coarse-graining bears the promise of finding simplified models such that long-time simulations of large-scale…

Chemical Physics · Physics 2019-09-04 Feliks Nüske , Lorenzo Boninsegna , Cecilia Clementi

Spatiotemporal graph neural networks (STGNNs) have shown promising results in many domains, from forecasting to epidemiology. However, understanding the dynamics learned by these models and explaining their behaviour is significantly more…

Machine Learning · Computer Science 2026-04-08 Michele Guerra , Simone Scardapane , Filippo Maria Bianchi

This paper presents a novel identification approach of Koopman models of nonlinear systems with inputs under rather general noise conditions. The method uses deep state-space encoders based on the concept of state reconstructability and an…

Systems and Control · Electrical Eng. & Systems 2026-05-12 Lucian Cristian Iacob , Máté Szécsi , Gerben Izaak Beintema , Maarten Schoukens , Roland Tóth

We introduce two novel generalizations of the Koopman operator method of nonlinear dynamic modeling. Each of these generalizations leads to greatly improved predictive performance without sacrificing a unique trait of Koopman methods: the…

Systems and Control · Electrical Eng. & Systems 2020-10-15 Span Spanbauer , Ian Hunter

The accurate modeling of dynamics in interactive environments is critical for successful long-range prediction. Such a capability could advance Reinforcement Learning (RL) and Planning algorithms, but achieving it is challenging.…

Machine Learning · Computer Science 2024-05-14 Arnab Kumar Mondal , Siba Smarak Panigrahi , Sai Rajeswar , Kaleem Siddiqi , Siamak Ravanbakhsh

A majority of methods from dynamical systems analysis, especially those in applied settings, rely on Poincar\'e's geometric picture that focuses on "dynamics of states". While this picture has fueled our field for a century, it has shown…

Dynamical Systems · Mathematics 2013-01-01 Marko Budišić , Ryan M. Mohr , Igor Mezić

Continuous monitoring of the spatio-temporal dynamic behavior of critical infrastructure networks, such as the power systems, is a challenging but important task. In particular, accurate and timely prediction of the (electro-mechanical)…

Systems and Control · Electrical Eng. & Systems 2022-02-17 Sai Pushpak Nandanoori , Sheng Guan , Soumya Kundu , Seemita Pal , Khushbu Agarwal , Yinghui Wu , Sutanay Choudhury

Modal synthesis methods are a long-standing approach for modelling distributed musical systems. In some cases extensions are possible in order to handle geometric nonlinearities. One such case is the high-amplitude vibration of a string,…

Sound · Computer Science 2025-05-16 Victor Zheleznov , Stefan Bilbao , Alec Wright , Simon King

Nonlinear dynamical effects are crucial to the operation of many agile robotic systems. Koopman-based model learning methods can capture these nonlinear dynamical system effects in higher dimensional lifted bilinear models that are amenable…

Robotics · Computer Science 2021-10-22 Carl Folkestad , Skylar X. Wei , Joel W. Burdick

In this paper, we present a new data-driven method for learning stable models of nonlinear systems. Our model lifts the original state space to a higher-dimensional linear manifold using Koopman embeddings. Interestingly, we prove that…

Machine Learning · Computer Science 2021-10-14 Fletcher Fan , Bowen Yi , David Rye , Guodong Shi , Ian R. Manchester

Nonlinearity plays a crucial role in deep neural networks. In this paper, we investigate the degree to which the nonlinearity of the neural network is essential. For this purpose, we employ the Koopman operator, extended dynamic mode…

Machine Learning · Computer Science 2024-07-08 Naoki Sugishita , Kayo Kinjo , Jun Ohkubo

Koopman operator theory has been successfully applied to problems from various research areas such as fluid dynamics, molecular dynamics, climate science, engineering, and biology. Applications include detecting metastable or coherent sets,…

Quantum Physics · Physics 2022-07-13 Stefan Klus , Feliks Nüske , Sebastian Peitz

Most modern reinforcement learning algorithms optimize a cumulative single-step cost along a trajectory. The optimized motions are often 'unnatural', representing, for example, behaviors with sudden accelerations that waste energy and lack…

Machine Learning · Computer Science 2024-07-03 Motoya Ohnishi , Isao Ishikawa , Kendall Lowrey , Masahiro Ikeda , Sham Kakade , Yoshinobu Kawahara

We use a deep Koopman operator-theoretic formalism to develop a novel causal discovery algorithm, Kausal. Causal discovery aims to identify cause-effect mechanisms for better scientific understanding, explainable decision-making, and more…

Machine Learning · Computer Science 2025-05-22 Juan Nathaniel , Carla Roesch , Jatan Buch , Derek DeSantis , Adam Rupe , Kara Lamb , Pierre Gentine
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