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Molecular dynamics simulations are indispensable for exploring the behavior of atoms and molecules. Grounded in quantum mechanical principles, quantum molecular dynamics provides high predictive power but its computational cost is dominated…

Chemical Physics · Physics 2025-09-10 Siu Wun Cheung , Youngsoo Choi , Jean-Luc Fattebert , Daniel Osei-Kuffuor

This study investigates the application of deep-learning diffusion models for the super-resolution of weather data, a novel approach aimed at enhancing the spatial resolution and detail of meteorological variables. Leveraging the…

Machine Learning · Computer Science 2024-09-02 Jan Martinů , Petr Šimánek

Effective models for slender structures derived from well-known plate (or shell) theories are justified within the limit of a small thickness, and may therefore prove limited for intermediate slenderness. On the other hand, direct 3D…

Numerical Analysis · Mathematics 2026-03-30 Jean Ruel , Frédéric Legoll , Arthur Lebée , Ludovic Chamoin

Diffusion models have recently been successfully applied to a wide range of robotics applications for learning complex multi-modal behaviors from data. However, prior works have mostly been confined to single-robot and small-scale…

Robotics · Computer Science 2025-05-08 Yorai Shaoul , Itamar Mishani , Shivam Vats , Jiaoyang Li , Maxim Likhachev

In this work we present the mathematical models for single-phase flow in fractured porous media. An overview of the most common approaches is considered, which includes continuous fracture models and discrete fracture models. For the…

Computational Physics · Physics 2020-04-01 Luca Formaggia , Anna Scotti , Alessio Fumagalli

Model order reduction (MOR) has long been a mainstream strategy to accelerate large-scale transient circuit simulation. Dynamic Mode Decomposition (DMD) represents a novel data-driven characterization method, extracting dominant dynamical…

Signal Processing · Electrical Eng. & Systems 2025-08-06 Na Liu , Chengliang Dai , Qiuyue Wu , Qiuqi Li , Guoxiong Cai

This paper focuses on a new framework for reduced order modelling of non-intrusive data with application to 2D flows. To overcome the shortcomings of intrusive model order reduction usually derived by combining the POD and the Galerkin…

Numerical Analysis · Mathematics 2016-11-16 D. A. Bistrian , I. M. Navon

This article performs a unified convergence analysis of a variety of numerical methods for a model of the miscible displacement of one incompressible fluid by another through a porous medium. The unified analysis is enabled through the…

Numerical Analysis · Mathematics 2018-03-07 Jérôme Droniou , Robert Eymard , Alain Prignet , Kyle S. Talbot

We present a novel parametric finite element approach for simulating the surface diffusion of curves and surfaces. Our core strategy incorporates a predictor-corrector time-stepping method, which enhances the classical first-order temporal…

Numerical Analysis · Mathematics 2024-12-17 Wei Jiang , Chunmei Su , Ganghui Zhang , Lian Zhang

Dynamic mode decomposition (DMD) is a popular technique for modal decomposition, flow analysis, and reduced-order modeling. In situations where a system is time varying, one would like to update the system's description online as time…

Optimization and Control · Mathematics 2017-07-11 Hao Zhang , Clarence W. Rowley , Eric A. Deem , Louis N. Cattafesta

In this contribution we propose reduced order methods to fast and reliably solve parametrized optimal control problems governed by time dependent nonlinear partial differential equations. Our goal is to provide a tool to deal with the time…

Numerical Analysis · Mathematics 2023-08-08 Francesco Ballarin , Gianluigi Rozza , Maria Strazzullo

The numerical treatment of fluid-particle systems is a very challenging problem because of the complex coupling phenomena occurring between the two phases. Although accurate mathematical modelling is available to address this kind of…

Numerical Analysis · Mathematics 2024-03-22 Arash Hajisharifi , Rahul Halder , Michele Girfoglio , Andrea Beccari , Domenico Bonanni , Gianluigi Rozza

In medical imaging, the diffusion models have shown great potential for synthetic image generation tasks. However, these approaches often lack the interpretable connections between the generated and real images and can create anatomically…

Image and Video Processing · Electrical Eng. & Systems 2026-02-12 Jian-Qing Zheng , Yuanhan Mo , Yang Sun , Jiahua Li , Fuping Wu , Ziyang Wang , Tonia Vincent , Bartłomiej W. Papież

This article provides a reduced-order modelling framework for turbulent compressible flows discretized by the use of finite volume approaches. The basic idea behind this work is the construction of a reduced-order model capable of providing…

Fluid Dynamics · Physics 2024-05-31 Matteo Zancanaro , Valentin Nkana Ngan , Giovanni Stabile , Gianluigi Rozza

We have deluge of data in time series format for numerous phenomena. The number of snapshots, resolution and many other factors come into play as we look to identify the dynamics in a given problem. The pre-processing and post-processing…

Signal Processing · Electrical Eng. & Systems 2020-01-13 Mohammad N. Murshed , M. Monir Uddin

We propose enforcing constraints on Model-Based Diffusion by introducing emerging barrier functions inspired by interior point methods. We demonstrate that the standard Model-Based Diffusion algorithm can lead to catastrophic performance…

Robotics · Computer Science 2026-03-10 Raghav Mishra , Ian R. Manchester

This work investigates the use of sparse polynomial interpolation as a model order reduction method for the incompressible Navier-Stokes equations. Numerical results are presented underscoring the validity of sparse polynomial…

Numerical Analysis · Mathematics 2022-01-11 Martin W. Hess , Gianluigi Rozza

An accurate modeling of reactive flows in fractured porous media is a key ingredient to obtain reliable numerical simulations of several industrial and environmental applications. For some values of the physical parameters we can observe…

Numerical Analysis · Mathematics 2020-11-10 Luca Formaggia , Alessio Fumagalli , Anna Scotti

Generative diffusion models have achieved remarkable success in producing high-quality images. However, these models typically operate in continuous intensity spaces, diffusing independently across pixels and color channels. As a result,…

Graphics · Computer Science 2025-05-20 Javier E. Santos , Agnese Marcato , Roman Colman , Nicholas Lubbers , Yen Ting Lin

Computational modeling of the brain has become a key part of understanding how the brain clears metabolic waste, but patient-specific modeling on a significant scale is still out of reach with current methods. We introduce a novel approach…

Quantitative Methods · Quantitative Biology 2025-06-12 Andreas Solheim , Geir Ringstand , Per Kristian Eide , Kent-Andre Mardal