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The combinations of machine learning with ab initio methods have attracted much attention for their potential to resolve the accuracy-efficiency dilemma and facilitate calculations for large-scale systems. Recently, equivariant message…

Computational Physics · Physics 2025-09-08 Zhixin Liang , Yunlong Wang , Chi Ding , Junjie Wang , Hui-Tian Wang , Dingyu Xing , Jian Sun

Port-Hamiltonian systems have gained a lot of attention in recent years due to their inherent valuable properties in modeling and control. In this paper, we are interested in constructing linear port-Hamiltonian systems from time-domain…

Systems and Control · Electrical Eng. & Systems 2020-11-18 Karim Cherifi , Pawan Goyal , Peter Benner

Quantum machine learning algorithms have emerged to be a promising alternative to their classical counterparts as they leverage the power of quantum computers. Such algorithms have been developed to solve problems like electronic structure…

Chemical Physics · Physics 2021-10-29 Manas Sajjan , Shree Hari Sureshbabu , Sabre Kais

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

The interpretation of deep learning as a dynamical system has gained a considerable attention in recent years as it provides a promising framework. It allows for the use of existing ideas from established fields of mathematics for studying…

Optimization and Control · Mathematics 2021-06-09 Nader Ganaba

We present a method for learning generalized Hamiltonian decompositions of ordinary differential equations given a set of noisy time series measurements. Our method simultaneously learns a continuous time model and a scalar energy function…

Machine Learning · Computer Science 2021-04-16 Kevin L. Course , Trefor W. Evans , Prasanth B. Nair

Artificial neural networks have been recently introduced as a general ansatz to compactly represent many- body wave functions. In conjunction with Variational Monte Carlo, this ansatz has been applied to find Hamil- tonian ground states and…

Strongly Correlated Electrons · Physics 2018-10-24 Kenny Choo , Giuseppe Carleo , Nicolas Regnault , Titus Neupert

In this paper we design discrete port-Hamiltonian systems systematically in two different ways, by applying discrete gradient methods and splitting methods respectively. The discrete port-Hamiltonian systems we get satisfy a discrete notion…

Numerical Analysis · Mathematics 2017-06-28 Elena Celledoni , Eirik Hoel Høiseth

We provide a fully nonlinear port-Hamiltonian formulation for discrete elastodynamical systems as well as a structure-preserving time discretization. The governing equations are obtained in a variational manner and represent index-1…

Dynamical Systems · Mathematics 2025-06-23 Philipp L. Kinon , Tobias Thoma , Peter Betsch , Paul Kotyczka

We introduce a robust framework for learning various generalized Hamiltonian dynamics from noisy, sparse phase-space data and in an unsupervised manner based on variational Bayesian inference. Although conservative, dissipative, and…

Machine Learning · Computer Science 2025-09-10 Luke McLennan , Yi Wang , Ryan Farell , Minh Nguyen , Chandrajit Bajaj

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

Large-scale cyber-physical systems require that control policies are distributed, that is, that they only rely on local real-time measurements and communication with neighboring agents. Optimal Distributed Control (ODC) problems are,…

Systems and Control · Electrical Eng. & Systems 2021-12-17 Luca Furieri , Clara Lucía Galimberti , Muhammad Zakwan , Giancarlo Ferrari-Trecate

Reconstructing a system Hamiltonian through measurements on its eigenstates is an important inverse problem in quantum physics. Recently, it was shown that generic many-body local Hamiltonians can be recovered by local measurements without…

Quantum Physics · Physics 2022-02-14 Chenfeng Cao , Shi-Yao Hou , Ningping Cao , Bei Zeng

We construct effective Hamiltonians which despite their apparently nonrelativistic form incorporate relativistic effects by involving parameters which depend on the relevant momentum. For some potentials the corresponding energy eigenvalues…

High Energy Physics - Phenomenology · Physics 2016-09-01 Wolfgang LUCHA , Franz F. SCHÖBERL

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

A new formulation for the modular construction of flexible multibody systems is presented. By rearranging the equations for a flexible floating body and introducing the appropriate canonical momenta, the model is recast into a coupled…

Classical Physics · Physics 2020-10-07 Andrea Brugnoli , Daniel Alazar , Valérie Pommier-Budinger , Denis Matignon

While there is currently a lot of enthusiasm about "big data", useful data is usually "small" and expensive to acquire. In this paper, we present a new paradigm of learning partial differential equations from {\em small} data. In…

Artificial Intelligence · Computer Science 2018-01-17 Maziar Raissi , George Em Karniadakis

Hamiltonian Learning (HL) is essential for validating quantum systems in quantum computing. Not all Hamiltonians can be uniquely recovered from a steady state. HL success depends on the Hamiltonian model and steady state. Here, we analyze…

Quantum Physics · Physics 2023-09-19 Jing Zhou , D. L. Zhou

We consider infinite dimensional port-Hamiltonian systems. Based on a power balance relation we introduce the port-Hamiltonian system representation where we pay attention to two different scenarios, namely the non-differential operator…

Optimization and Control · Mathematics 2013-08-07 Markus Schöberl , Andreas Siuka

This paper builds on our earlier proposal for construction of a positive inner product for pseudo-Hermitian Hamiltonians and we give several examples to clarify our method. We show through the example of the harmonic oscillator how our…

Quantum Physics · Physics 2011-04-07 Ashok Das , L. Greenwood