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Transient computational fluid dynamics (CFD) remains expensive when long horizons and multi-scale turbulence are involved. Data-driven surrogates promise relief, yet many degrade over multiple steps or drift from physical behavior. This…

Fluid Dynamics · Physics 2025-12-01 Blaise Madiega , Mathieu Olivier

Normalizing flows map an independent set of latent variables to their samples using a bijective transformation. Despite the exact correspondence between samples and latent variables, their high level relationship is not well understood. In…

Machine Learning · Statistics 2022-02-16 Edmond Cunningham , Adam Cobb , Susmit Jha

Molecular dynamics (MD) simulation is essential for various scientific domains but computationally expensive. Learning-based force fields have made significant progress in accelerating ab-initio MD simulation but are not fast enough for…

Machine Learning · Computer Science 2023-08-29 Xiang Fu , Tian Xie , Nathan J. Rebello , Bradley D. Olsen , Tommi Jaakkola

Modeling long horizon marked event sequences is a fundamental challenge in many real-world applications, including healthcare, finance, and user behavior modeling. Existing neural temporal point process models are typically autoregressive,…

Machine Learning · Computer Science 2025-08-08 Xiao Shou

The spatiotemporal evolution of pulsating turbulent pipe flow was predicted by deep learning. A convolutional neural network (CNN) and long short-term memory (LSTM) were employed for long-term prediction by recursively predicting the local…

Fluid Dynamics · Physics 2026-01-01 Sota Kumazawa , Yasuhiro Yoshida , Tomohiro Nimura , Akira Murata , Kaoru Iwamoto

The efficient simulation of quantum dynamics and ground states is a central challenge in physics and a key frontier for quantum advantage. While short-time evolution in one-dimensional systems can often be simulated classically, extending…

Quantum Physics · Physics 2025-09-22 Yusen Wu , Yukun Zhang , Chuan Wang , Xiao Yuan

Learning long-horizon robotic manipulation requires jointly achieving expressive behavior modeling, real-time inference, and stable execution, which remains challenging for existing generative policies. Diffusion-based approaches offer…

Robotics · Computer Science 2026-05-19 Wu Songwei , Jiang Zhiduo , Sun Wandong , Xie Guanghu , Zhao Rui , Liu Hong , Liu Yang

Current density modeling approaches suffer from at least one of the following shortcomings: expensive training, slow inference, approximate likelihood, mode collapse or architectural constraints like bijective mappings. We propose a simple…

Machine Learning · Computer Science 2025-10-01 Marcello Massimo Negri , Jonathan Aellen , Manuel Jahn , AmirEhsan Khorashadizadeh , Volker Roth

Recently, machine learning Hamiltonian (MLH) models have gained traction as fast approximations of electronic structures such as orbitals and electron densities, while also enabling direct evaluation of energies and forces from their…

Modeling of conservative systems with neural networks is an area of active research. A popular approach is to use Hamiltonian neural networks (HNNs) which rely on the assumptions that a conservative system is described with Hamilton's…

Artificial Intelligence · Computer Science 2024-07-18 Katsiaryna Haitsiukevich , Alexander Ilin

We introduce Categorical Flow Maps, a flow-matching method for accelerated few-step generation of categorical data via self-distillation. Building on recent variational formulations of flow matching and the broader trend towards accelerated…

Partial observations of continuous time-series dynamics at arbitrary time stamps exist in many disciplines. Fitting this type of data using statistical models with continuous dynamics is not only promising at an intuitive level but also has…

Machine Learning · Computer Science 2021-10-29 Ruizhi Deng , Marcus A. Brubaker , Greg Mori , Andreas M. Lehrmann

Quantum systems governed by time-dependent Hamiltonians pose significant challenges for the accurate computation of unitary time-evolution operators, which are essential for predicting quantum state dynamics. In this work, we introduce a…

Quantum Physics · Physics 2026-01-21 Antonio Guerra , Daniel Uzcategui-Contreras , Aldo Delgado , Esteban S. Gómez

Flow Matching has limited ability in achieving one-step generation due to its reliance on learned curved trajectories. Previous studies have attempted to address this limitation by either modifying the coupling distribution to prevent…

Machine Learning · Computer Science 2025-11-25 Chenrui Ma , Xi Xiao , Tianyang Wang , Xiao Wang , Yanning Shen

In this paper, we propose an approach to learn stable dynamical systems evolving on Riemannian manifolds. The approach leverages a data-efficient procedure to learn a diffeomorphic transformation that maps simple stable dynamical systems…

Robotics · Computer Science 2023-09-27 Matteo Saveriano , Fares J. Abu-Dakka , Ville Kyrki

Continuous normalizing flows (CNFs) learn an ordinary differential equation to transform prior samples into data. Flow matching (FM) has recently emerged as a simulation-free approach for training CNFs by regressing a velocity model towards…

Machine Learning · Statistics 2024-05-28 Tianyu Xie , Yu Zhu , Longlin Yu , Tong Yang , Ziheng Cheng , Shiyue Zhang , Xiangyu Zhang , Cheng Zhang

Recently, world models have been incorporated into the autonomous driving systems to improve the planning reliability. Existing approaches typically predict future states through appearance generation or deterministic regression, which…

Computer Vision and Pattern Recognition · Computer Science 2026-05-05 Xiaolu Liu , Yicong Li , Song Wang , Junbo Chen , Angela Yao , Jianke Zhu

We introduce a methodology for seeking conservation laws within a Hamiltonian dynamical system, which we term ``neural deflation''. Inspired by deflation methods for steady states of dynamical systems, we propose to {iteratively} train a…

Pattern Formation and Solitons · Physics 2023-03-29 Wei Zhu , Hong-Kun Zhang , P. G. Kevrekidis

We develop a technique for finding the dynamical evolution in time of an averaged density matrix. The result is an equation of evolution that includes an Effective Hamiltonian, as well as decoherence terms in Lindblad form. Applying the…

Quantum Physics · Physics 2013-03-28 Omar Gamel , Daniel F. V. James

This paper firstly show that a recent model (Tian et al., Transpn. Res. B 71, 138-157, 2015) is not able to well replicate the evolution concavity in traffic flow, i.e. the standard deviation of vehicles increases in a concave/linear way…

Cellular Automata and Lattice Gases · Physics 2015-07-16 Junfang Tian , Rui Jiang , Guangyu Li , Martin Treiber , Ning Jia , Shoufeng Ma