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Identifying unfamiliar inputs, also known as out-of-distribution (OOD) detection, is a crucial property of any decision making process. A simple and empirically validated technique is based on deep ensembles where the variance of…

Machine Learning · Computer Science 2022-10-19 Seijin Kobayashi , Pau Vilimelis Aceituno , Johannes von Oswald

Neural operators can learn nonlinear mappings between function spaces and offer a new simulation paradigm for real-time prediction of complex dynamics for realistic diverse applications as well as for system identification in science and…

Computational Physics · Physics 2022-03-23 Lu Lu , Xuhui Meng , Shengze Cai , Zhiping Mao , Somdatta Goswami , Zhongqiang Zhang , George Em Karniadakis

Numerically solving partial differential equations typically requires fine discretization to resolve necessary spatiotemporal scales, which can be computationally expensive. Recent advances in deep learning have provided a new approach to…

Machine Learning · Computer Science 2023-09-22 Saurabh Patil , Zijie Li , Amir Barati Farimani

Neural operators have been applied in various scientific fields, such as solving parametric partial differential equations, dynamical systems with control, and inverse problems. However, challenges arise when dealing with input functions…

Numerical Analysis · Mathematics 2023-10-31 Zecheng Zhang , Christian Moya , Lu Lu , Guang Lin , Hayden Schaeffer

Operational forecasting centers are investing in decadal (1-10 year) forecast systems to support long-term decision making for a more climate-resilient society. One method that has previously been employed is the Dynamic Mode Decomposition…

Machine Learning · Computer Science 2021-06-22 Eduardo Rodrigues , Bianca Zadrozny , Campbell Watson , David Gold

Existing work in scientific machine learning (SciML) has shown that data-driven learning of solution operators can provide a fast approximate alternative to classical numerical partial differential equation (PDE) solvers. Of these, Neural…

Machine Learning · Computer Science 2024-06-13 S. Chandra Mouli , Danielle C. Maddix , Shima Alizadeh , Gaurav Gupta , Andrew Stuart , Michael W. Mahoney , Yuyang Wang

Learning under non-smooth objectives remains a fundamental challenge in machine learning, as abrupt changes in conditioning variables can induce highly non-smooth loss landscapes and destabilize optimization. This difficulty is particularly…

Optimization and Control · Mathematics 2026-03-16 Gyeongwan Gu , Jinwoo Hyun , Hyeontae Jo , Jae Kyoung Kim

Modeling of turbulent flows is still challenging. One way to deal with the large scale separation due to turbulence is to simulate only the large scales and model the unresolved contributions as done in large-eddy simulation (LES). This…

Computational Physics · Physics 2019-10-03 Mathis Bode , Michael Gauding , Konstantin Kleinheinz , Heinz Pitsch

When simulating multiscale systems, where some fields cannot be fully prescribed despite their effects on the simulation's accuracy, closure models are needed. This phenomenon is observed in turbulent fluid dynamics, where Large Eddy…

Fluid Dynamics · Physics 2025-12-01 Eduardo Vital , Jean-Marc Gratien , Yassine Ayoun , Thibault Faney , Julien Bohbot

The Koopman operator has recently garnered much attention for its value in dynamical systems analysis and data-driven model discovery. However, its application has been hindered by the computational complexity of extended dynamic mode…

Machine Learning · Computer Science 2017-12-11 Enoch Yeung , Soumya Kundu , Nathan Hodas

Tidal energy is one of the key components in increasing the penetration of renewable energy. High tidal energy penetration into the electrical grid depends on accurate tidal current speed forecasting. Model inaccuracies hinder forecast…

Machine Learning · Computer Science 2026-03-03 Tengfei Cheng , Yangdi Huang , Ling Xiao , Yunxuan Dong

Physical systems whose dynamics are governed by partial differential equations (PDEs) find applications in numerous fields, from engineering design to weather forecasting. The process of obtaining the solution from such PDEs may be…

Machine Learning · Computer Science 2022-09-21 Pratyush Bhatt , Yash Kumar , Azzeddine Soulaimani

Data-driven turbulence modeling is experiencing a surge in interest following algorithmic and hardware developments in the data sciences. We discuss an approach using the differentiable physics paradigm that combines known physics with…

Operator learning enables fast surrogate modeling of high-dimensional dynamical systems, but existing approaches face two fundamental limitations: quadratic inference complexity and unreliable uncertainty quantification in safety-critical…

Machine Learning · Computer Science 2026-05-04 Purav Matlia , Christian Moya , Guang Lin

Integrating machine learning techniques in established numerical solvers represents a modern approach to enhancing computational fluid dynamics simulations. Within the lattice Boltzmann method (LBM), the collision operator serves as an…

Computational Physics · Physics 2024-12-12 Mario Christopher Bedrunka , Tobias Horstmann , Ben Picard , Dirk Reith , Holger Foysi

In this work, we present a novel data-based approach to turbulence modelling for Large Eddy Simulation (LES) by artificial neural networks. We define the exact closure terms including the discretization operators and generate training data…

Computational Engineering, Finance, and Science · Computer Science 2019-10-09 Andrea D. Beck , David G. Flad , Claus-Dieter Munz

We establish a discrete operator--theoretic framework for the analysis of implicit Euler and Lie--Trotter splitting schemes for delay differential equations (DDEs). Both schemes are formulated in terms of discrete resolvent operators acting…

Optimization and Control · Mathematics 2026-03-03 Hideki Kawahara

We present a novel technique for assessing the dynamics of multiphase fluid flow in the oil reservoir. We demonstrate an efficient workflow for handling the 3D reservoir simulation data in a way which is orders of magnitude faster than the…

Despite a cost-effective option in practical engineering, Reynolds-averaged Navier-Stokes simulations are facing the ever-growing demand for more accurate turbulence models. Recently, emerging machine learning techniques are making…

Fluid Dynamics · Physics 2021-05-04 Chao Jiang

Fast, geometry-generalizing surrogates for unsteady flow remain challenging. We present a time-dependent, geometry-aware Deep Operator Network that predicts velocity fields for moderate-Re flows around parametric and non-parametric shapes.…

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