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Data and pipeline parallelism are key strategies for scaling neural network training across distributed devices, but their high communication cost necessitates co-located computing clusters with fast interconnects, limiting their…

Combined-resolution simulations are an effective way to study molecular properties across a range of length- and time-scales. These simulations can benefit from adaptive boundaries that allow the high-resolution region to adapt (change size…

Computational Physics · Physics 2018-05-09 Jason A. Wagoner , Vijay S. Pande

Adaptive spatial meshing has proven invaluable for the accurate, efficient computation of solutions of time dependent partial differential equations. In a DA context the use of adaptive spatial meshes addresses several factors that place…

Numerical Analysis · Mathematics 2025-02-17 Jeremiah Buenger , Weizhang Huang , Erik Van Vleck

The calculation of potential energy surfaces for quantum dynamics can be a time consuming task -- especially when a high level of theory for the electronic structure calculation is required. We propose an adaptive interpolation algorithm…

Chemical Physics · Physics 2016-08-24 Markus Kowalewski , Elisabeth Larsson , Alfa Heryudono

Pixel- and voxel-based representations of microstructures obtained from tomographic imaging methods is an established standard in computational materials science. The corresponding highly resolved, uniform discretitization in numerical…

Numerical Analysis · Mathematics 2019-08-27 Andreas Fischer , Bernhard Eidel

Adaptive mesh refinement (AMR) is often used when solving time-dependent partial differential equations using numerical methods. It enables time-varying regions of much higher resolution, which can be used to track discontinuities in the…

Numerical Analysis · Mathematics 2018-10-03 Brisa N Davis , Randall J LeVeque

In this work, we present an adaptive unfitted finite element scheme that combines the aggregated finite element method with parallel adaptive mesh refinement. We introduce a novel scalable distributed-memory implementation of the resulting…

Numerical Analysis · Mathematics 2021-09-30 Santiago Badia , Alberto F. Martín , Eric Neiva , Francesc Verdugo

Linear algebra algorithms are used widely in a variety of domains, e.g machine learning, numerical physics and video games graphics. For all these applications, loop-level parallelism is required to achieve high performance. However,…

Machine Learning · Computer Science 2020-01-24 G. Laberge , S. Shirzad , P. Diehl , H. Kaiser , S. Prudhomme , A. Lemoine

We present numerical experiments for geophysics electromagnetic (EM) modeling based upon high-order edge elements and supervised $h+p$ refinement approaches on massively parallel computers. Our high-order $h+p$ refinement strategy is based…

Data assimilation algorithms integrate prior information from numerical model simulations with observed data. Ensemble-based filters, regarded as state-of-the-art, are widely employed for large-scale estimation tasks in disciplines such as…

Numerical Analysis · Mathematics 2024-05-24 Iris Rammelmüller , Gottfried Hastermann , Jana de Wiljes

We consider adaptive finite element methods for solving a multiscale system consisting of a macroscale model comprising a system of reaction-diffusion partial differential equations coupled to a microscale model comprising a system of…

Numerical Analysis · Mathematics 2015-06-22 A. Johansson , J. H. Chaudry , V. Carey , D. Estep , V. Ginting , M. Larson , S. Tavener

We present a new adaptive resolution technique for efficient particle-based multiscale molecular dynamics (MD) simulations. The presented approach is tailor-made for molecular systems where atomistic resolution is required only in spatially…

Soft Condensed Matter · Physics 2007-05-23 Matej Praprotnik , Luigi Delle Site , Kurt Kremer

We present a non-parametric change-point detection approach to detect potentially sparse changes in a time series of high-dimensional observations or non-Euclidean data objects. We target a change in distribution that occurs in a small,…

Methodology · Statistics 2025-05-29 Alan Moore , Lynna Chu , Zhengyuan Zhu

We consider the problem of non-parametric regression with a potentially large number of covariates. We propose a convex, penalized estimation framework that is particularly well-suited for high-dimensional sparse additive models. The…

Methodology · Statistics 2019-06-19 Asad Haris , Ali Shojaie , Noah Simon

Computations have helped elucidate the dynamics of Earth's mantle for several decades already. The numerical methods that underlie these simulations have greatly evolved within this time span, and today include dynamically changing and…

Computational Engineering, Finance, and Science · Computer Science 2017-05-09 Timo Heister , Juliane Dannberg , Rene Gassmöller , Wolfgang Bangerth

I provide a pedagogic review of adaptive mesh refinement (AMR) radiation hydrodynamics (RHD) methods and codes used in simulations of star formation, at a level suitable for researchers who are not computational experts. I begin with a…

Instrumentation and Methods for Astrophysics · Physics 2015-05-19 Mark R. Krumholz

A classic approach for solving differential equations with neural networks builds upon neural forms, which employ the differential equation with a discretisation of the solution domain. Making use of neural forms for time-dependent…

Neural and Evolutionary Computing · Computer Science 2022-09-02 Toni Schneidereit , Michael Breuß

Conforming hexahedral (hex) meshes are favored in simulation for their superior numerical properties, yet automatically decomposing a general 3D volume into a conforming hex mesh remains a formidable challenge. Among existing approaches,…

Computational Geometry · Computer Science 2026-01-07 Hua Tong , Yongjie Jessica Zhang

Mixed-paradigm process models integrate strengths of procedural and declarative representations like Petri nets and Declare. They are specifically interesting for process mining because they allow capturing complex behaviour in a compact…

Formal Languages and Automata Theory · Computer Science 2020-11-30 Boudewijn van Dongen , Johannes De Smedt , Claudio Di Ciccio , Jan Mendling

We present an adaptive refinement algorithm for T-splines on unstructured 2D meshes. While for structured 2D meshes, one can refine elements alternatingly in horizontal and vertical direction, such an approach cannot be generalized directly…

Numerical Analysis · Mathematics 2022-05-03 Roland Maier , Philipp Morgenstern , Thomas Takacs