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    Zhuangkun Wei, Bin Li, Chengyao Sun, Weisi Guo

    Networked nonlinear dynamics underpin the complex functionality of many engineering, social, biological, and ecological systems. Monitoring the networked dynamics via the minimum subset of nodes is essential for a variety of scientific and operational purposes. When there is a lack …

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    Networked nonlinear dynamics underpin the complex functionality of many engineering, social, biological, and ecological systems. Monitoring the networked dynamics via the minimum subset of nodes is essential for a variety of scientific and operational purposes. When there is a lack of a explicit model and networked signal space, traditional evolution analysis and non-convex methods are insufficient. An important data-driven state-of-the-art method use the Koopman operator to generate a linear evolution model for a vector-valued observable of original state-space. As a result, one can derive a sampling strategy via the linear evolution property of observable. However, current polynomial Koopman operators result in a large sampling space due to: (i) the large size of polynomial based observables ($O(N^2)$, $N$ number of nodes in network), and (ii) not factoring in the nonlinear dependency between observables. In this work, to achieve linear scaling ($O(N)$) and a small set of sampling nodes, we propose to combine a novel Log-Koopman operator and nonlinear Graph Fourier Transform (NL-GFT) scheme. First, the Log-Koopman operator is able to reduce the size of observables by transforming multiplicative poly-observable to logarithm summation. Second, a nonlinear GFT concept and sampling theory are provided to exploit the nonlinear dependence of observables for Koopman linearized evolution analysis. Combined, the sampling and reconstruction algorithms are designed and demonstrated on two established application areas. The results demonstrate that the proposed Log-Koopman NL-GFT scheme can (i) linearize unknown nonlinear dynamics using $O(N)$ observables, and (ii) achieve lower number of sampling nodes, compared with the state-of-the art polynomial Koopman linear evolution analysis.

    Yue Chang, Peter Yichen Chen, Eitan Grinspun, Maurizio M. Chiaramonte

    We present a low-rank Koopman operator formulation for accelerating deformable subspace simulation. Using a Dynamic Mode Decomposition (DMD) parameterization of the Koopman operator, our method learns the temporal evolution of deformable dynamics and predicts future states through efficient matrix evaluations …

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    We present a low-rank Koopman operator formulation for accelerating deformable subspace simulation. Using a Dynamic Mode Decomposition (DMD) parameterization of the Koopman operator, our method learns the temporal evolution of deformable dynamics and predicts future states through efficient matrix evaluations instead of sequential time integration. This yields log-linear scaling in the number of time steps and allows large portions of the trajectory to be skipped while retaining accuracy. The resulting temporal efficiency is especially advantageous for optimization tasks such as control and initial-state estimation, where the objective often depends largely on the final configuration. To broaden the scope of Koopman-based reduced-order models in graphics, we introduce a discretization-agnostic extension that learns shared dynamic behavior across multiple shapes and mesh resolutions. Prior DMD-based approaches have been restricted to a single shape and discretization, which limits their usefulness for tasks involving geometry variation. Our formulation generalizes across both shape and discretization, which enables fast shape optimization that was previously impractical for DMD models. This expanded capability highlights the potential of Koopman operator learning as a practical tool for efficient deformable simulation and design.

    Zhiyuan Liu, Guohui Ding, Lijun Chen, Enoch Yeung

    We propose an alternating optimization algorithm to the nonconvex Koopman operator learning problem for nonlinear dynamic systems. We show that the proposed algorithm will converge to a critical point with rate $O(1/T)$ and $O(\frac{1}{\log T})$ for the constant and diminishing …

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    We propose an alternating optimization algorithm to the nonconvex Koopman operator learning problem for nonlinear dynamic systems. We show that the proposed algorithm will converge to a critical point with rate $O(1/T)$ and $O(\frac{1}{\log T})$ for the constant and diminishing learning rates, respectively, under some mild conditions. To cope with the high dimensional nonlinear dynamical systems, we present the first-ever distributed Koopman operator learning algorithm. We show that the distributed Koopman operator learning has the same convergence properties as the centralized Koopman operator learning, in the absence of optimal tracker, so long as the basis functions satisfy a set of state-based decomposition conditions. Numerical experiments are provided to complement our theoretical results.

    Chang Yue, Peter Yichen Chen, Eitan Grinspun, Maurizio M. Chiaramonte

    We present a low-rank Koopman operator formulation for accelerating deformable subspace simulation. Using a Dynamic Mode Decomposition (DMD) parameterization of the Koopman operator, our method learns the temporal evolution of deformable dynamics and predicts future states through efficient matrix evaluations …

    Read the full abstract

    We present a low-rank Koopman operator formulation for accelerating deformable subspace simulation. Using a Dynamic Mode Decomposition (DMD) parameterization of the Koopman operator, our method learns the temporal evolution of deformable dynamics and predicts future states through efficient matrix evaluations instead of sequential time integration. This yields log-linear scaling in the number of time steps and allows large portions of the trajectory to be skipped while retaining accuracy. The resulting temporal efficiency is especially advantageous for optimization tasks such as control and initial-state estimation, where the objective often depends largely on the final configuration. To broaden the scope of Koopman-based reduced-order models in graphics, we introduce a discretization-agnostic extension that learns shared dynamic behavior across multiple shapes and mesh resolutions. Prior DMD-based approaches have been restricted to a single shape and discretization, which limits their usefulness for tasks involving geometry variation. Our formulation generalizes across both shape and discretization, which enables fast shape optimization that was previously impractical for DMD models. This expanded capability highlights the potential of Koopman operator learning as a practical tool for efficient deformable simulation and design.

    Nithin Govindarajan, Ryan Mohr, Shivkumar Chandrasekaran, Igor Mezić

    For the class of continuous, measure-preserving automorphisms on compact metric spaces, a procedure is proposed for constructing a sequence of finite-dimensional approximations to the associated Koopman operator on a Hilbert space. These finite-dimensional approximations are obtained from the so-called "periodic …

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    For the class of continuous, measure-preserving automorphisms on compact metric spaces, a procedure is proposed for constructing a sequence of finite-dimensional approximations to the associated Koopman operator on a Hilbert space. These finite-dimensional approximations are obtained from the so-called "periodic approximation" of the underlying automorphism and take the form of permutation operators. Results are established on how these discretizations approximate the Koopman operator spectrally. Specificaly, it is shown that both the spectral measure and the spectral projectors of these permutation operators converge weakly to their infinite dimensional counterparts. Based on this result, a numerical method is derived for computing the spectra of volume-preserving maps on the unit $m$-torus. The discretized Koopman operator can be constructed from solving a bipartite matching problem with $\mathcal{O}(\tilde{n}^{3m/2})$ time-complexity, where $\tilde{n}$ denotes the gridsize on each dimension. By exploiting the permutation structure of the discretized Koopman operator, it is further shown that the projections and density functions are computable in $\mathcal{O}(m \tilde{n}^{m} \log \tilde{n})$ operations using the FFT algorithm. Our method is illustrated on several classical examples of automorphisms on the torus that contain either a discrete, continuous, or a mixed spectra. In addition, the spectral properties of the Chirikov standard map are examined using our method.

    Nuzhat Khan, Indrakshi Dey

    Orchestrated collectives of large language model (LLM) agents that debate and vote are an emerging form of computational intelligence: the intelligent behaviour resides in the \emph{interaction}, not in any single agent. They improve task accuracy, yet remain black boxes at …

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    Orchestrated collectives of large language model (LLM) agents that debate and vote are an emerging form of computational intelligence: the intelligent behaviour resides in the \emph{interaction}, not in any single agent. They improve task accuracy, yet remain black boxes at the system level: there is no principled test of convergence, no bound on the rounds needed, and no faithful account of what drove a decision. This paper develops a novel framework based on Koopman operator theory and validates its theoretical guarantees on multi-agent consensus dynamics. Treating the collective as one nonlinear dynamical system on a communication graph, we read its essential behaviour off the spectrum of its Koopman transfer operator, an exact linear representation of the nonlinear dynamics estimated from interaction traces. The spectrum yields three machine-checkable certificates: the sub-dominant eigenvalue $λ_2$ fixes the intrinsic timescale of reasoning and yields a convergence deadline computable \emph{before} the debate runs; its eigenvector names the coherent factions the collective reasons in, and $|λ_2|$ certifies when that explanation is valid; and the leading spectral coordinates form a compressed, auditable message basis. On an attention-consensus model, the deadline tracks observed convergence with log--log correlation $0.93$ and bounds it in 96\% of 24 configurations; attribution is exact whenever the spectrum certifies metastability; eight of 32 coordinates preserve the decision at 99.7\% fidelity; and a certificate learned from 15 debates held on 60/60 held-out debates. The study runs in minutes on a CPU, making spectral certification a practical layer for trustworthy collective reasoning.

    Moritz Woelk, Wentao Tang

    This work proposes a data-driven Koopman modeling approach for nonlinear systems that takes into account the effect of noise, where the underlying noise distribution, autocorrelations, and governing differential equations are unknown. The method uses block coordinate descent to solve a …

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    This work proposes a data-driven Koopman modeling approach for nonlinear systems that takes into account the effect of noise, where the underlying noise distribution, autocorrelations, and governing differential equations are unknown. The method uses block coordinate descent to solve a regularized least squares problem by utilizing the extended dynamic mode decomposition (eDMD) framework for linearization and the log-likelihood characterization of the noise. Specifically, it learns a mapping to lift the nonlinear system to a higher-dimensional approximated linear system while also identifying the noise components in the lifted space. Furthermore, we prove theoretically that the identified model, when given new noisy data, can be used to predict the succeeding states with a guaranteed upper bound on the prediction error. Case studies are performed on a Van der Pol oscillator and a four-stage binary distillation column where unknown noise is present.

    Yuki Ito, Yu Tanaka, Keisuke Fujii

    Solving linear and nonlinear differential equations with large degrees of freedom is an important task for scientific and industrial applications. In order to solve such differential equations on a quantum computer, it is necessary to embed classical variables into a …

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    Solving linear and nonlinear differential equations with large degrees of freedom is an important task for scientific and industrial applications. In order to solve such differential equations on a quantum computer, it is necessary to embed classical variables into a quantum state. While the Carleman and Koopman-von Neumann embeddings have been investigated so far, the class of problems that can be mapped to the Schrödinger equation is not well understood even for linear differential equations. In this work, we investigate the conditions for linear differential equations to be mapped to the Schrödinger equation and solved on a quantum computer. Interestingly, we find that these conditions are identical for both Carleman and Koopman-von Neumann embeddings. We also compute the computational complexity associated with estimating the expected values of an observable. This is done by assuming a state preparation oracle, block encoding of the mapped Hamiltonian via either Carleman or Koopman-von Neumann embedding, and block encoding of the observable using $O(\log M)$ qubits with $M$ is the mapped system size. Furthermore, we consider a general classical quadratic Hamiltonian dynamics and find a sufficient condition to map it into the Schrödinger equation. As a special case, this includes the coupled harmonic oscillator model [Babbush et al., \cite{babbush_exponential_2023}]. We also find a concrete example that cannot be described as the coupled harmonic oscillator but can be mapped to the Schrödinger equation in our framework. These results are important in the construction of quantum algorithms for solving differential equations of large-degree-of-freedom.

    Masari Watanabe, Hirofumi Nishi, Taichi Kosugi, Shigekazu Hidaka, Ryo Sakurai, Yu-ichiro Matsushita

    We formulate the Green--Kubo transport coefficients of classical molecular dynamics as a readout problem for quantum algorithms using the Koopman--von Neumann (KvN) representation. Both NVE and Nosé--Hoover-type NVT dynamics are derived as unitary evolutions on Hilbert spaces associated with the …

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    We formulate the Green--Kubo transport coefficients of classical molecular dynamics as a readout problem for quantum algorithms using the Koopman--von Neumann (KvN) representation. Both NVE and Nosé--Hoover-type NVT dynamics are derived as unitary evolutions on Hilbert spaces associated with the corresponding classical phase spaces. Numerical benchmarks on finite grids show that the discretization error in the correlation function decreases as a power law in the number of grid points $N_z$. Equivalently, with $N_z=2^{n_z}$, the error decreases exponentially in the register size $n_z$, so a target accuracy $ε$ requires $n_z=\mathcal{O}(\log(1/ε))$ qubits. To read out a transport coefficient, we input a flux-excited state to quantum phase estimation (QPE). The probability $P_0$ of measuring the QPE ancilla register in the all-zero state corresponds to a Bartlett-windowed Green--Kubo integral. With maximum-likelihood amplitude estimation, the statistical estimation of $P_0$ defined by this QPE oracle improves from the $N_{\rm queries}^{-1/2}$ scaling of direct shot sampling to scaling close to $N_{\rm queries}^{-1}$. Our circuit-resource analysis shows that one step of the NVE propagator can be built with $\mathcal{O}(n^2)$ CX gates, where $n=n_x+n_p$ is the total number of position and momentum qubits. For the NVT propagator, the centered-difference Pauli-decomposition implementation of the Nosé--Hoover friction term scales as $\mathcal{O}(n_ξn_p\,2^{n_p})$, where $n_p$ and $n_ξ$ are the numbers of momentum and thermostat qubits, respectively. The proposed framework is a concrete step toward translating the principles of quantum algorithms into the transport-coefficient calculations required in practical molecular simulation.

    Stefan Klus, Péter Koltai, Christof Schütte

    Information about the behavior of dynamical systems can oftenbe obtained by analyzing the eigenvalues and corresponding eigenfunctions oflinear operators associated with a dynamical system. Examples of such operatorsare the Perron-Frobenius and the Koopman operator. In this paper, wewill review di …

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    Information about the behavior of dynamical systems can oftenbe obtained by analyzing the eigenvalues and corresponding eigenfunctions oflinear operators associated with a dynamical system. Examples of such operatorsare the Perron-Frobenius and the Koopman operator. In this paper, wewill review di erent methods that have been developed over the last decades tocompute nite-dimensional approximations of these in nite-dimensional operators- in particular Ulam's method and Extended Dynamic Mode Decomposition(EDMD) - and highlight the similarities and di erences between theseapproaches. The results will be illustrated using simple stochastic di erentialequations and molecular dynamics examples.