Numerical approximation of the Koopman-von Neumann equation: Operator learning and quantum computing

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Auteurs principaux: Klus, Stefan, Nüske, Feliks, Gelß, Patrick
Format: Preprint
Publié: 2026
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author Klus, Stefan
Nüske, Feliks
Gelß, Patrick
author_facet Klus, Stefan
Nüske, Feliks
Gelß, Patrick
contents The Koopman-von Neumann equation describes the evolution of wavefunctions associated with autonomous ordinary differential equations and can be regarded as a quantum physics-inspired formulation of classical mechanics. The main advantage compared to conventional transfer operators such as Koopman and Perron-Frobenius operators is that the Koopman-von Neumann operator is unitary even if the dynamics are non-Hamiltonian. Projecting this operator onto a finite-dimensional subspace allows us to represent it by a unitary matrix, which in turn can be expressed as a quantum circuit. We will exploit relationships between the Koopman-von Neumann framework and classical transfer operators in order to derive numerical methods to approximate the Koopman-von Neumann operator and its eigenvalues and eigenfunctions from data. Furthermore, we will show that the choice of basis functions and domain are crucial to ensure that the operator is well-defined. We will illustrate the results with the aid of guiding examples, including simple undamped and damped oscillators and the Lotka-Volterra model.
format Preprint
id arxiv_https___arxiv_org_abs_2604_08414
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Numerical approximation of the Koopman-von Neumann equation: Operator learning and quantum computing
Klus, Stefan
Nüske, Feliks
Gelß, Patrick
Dynamical Systems
Numerical Analysis
The Koopman-von Neumann equation describes the evolution of wavefunctions associated with autonomous ordinary differential equations and can be regarded as a quantum physics-inspired formulation of classical mechanics. The main advantage compared to conventional transfer operators such as Koopman and Perron-Frobenius operators is that the Koopman-von Neumann operator is unitary even if the dynamics are non-Hamiltonian. Projecting this operator onto a finite-dimensional subspace allows us to represent it by a unitary matrix, which in turn can be expressed as a quantum circuit. We will exploit relationships between the Koopman-von Neumann framework and classical transfer operators in order to derive numerical methods to approximate the Koopman-von Neumann operator and its eigenvalues and eigenfunctions from data. Furthermore, we will show that the choice of basis functions and domain are crucial to ensure that the operator is well-defined. We will illustrate the results with the aid of guiding examples, including simple undamped and damped oscillators and the Lotka-Volterra model.
title Numerical approximation of the Koopman-von Neumann equation: Operator learning and quantum computing
topic Dynamical Systems
Numerical Analysis
url https://arxiv.org/abs/2604.08414