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Recent results on supercomputers show that beyond 65K cores, the efficiency of molecular dynamics simulations of interfacial systems decreases significantly. In this paper, we introduce a dynamic cutoff method (DCM) for interfacial systems…

Computational Physics · Physics 2017-01-23 Paul Springer , Ahmed E. Ismail , Paolo Bientinesi

This paper focuses on multi-block optimization problems over transport polytopes, which underlie various applications including strongly correlated quantum physics and machine learning. Conventional block coordinate descent-type methods for…

Optimization and Control · Mathematics 2024-08-27 Yukuan Hu , Mengyu Li , Xin Liu , Cheng Meng

Reconfigurable multi-robot cells offer a promising approach to meet fluctuating assembly demands. However, the recurrent planning of their configurations introduces new challenges, particularly in generating optimized, coordinated…

Robotics · Computer Science 2026-05-29 Loris Schneider , Marc Ungen , Elias Huber , Jan-Felix Klein

A four-way coupling scheme for the direct numerical simulation of particle-laden flows is developed and analyzed. It employs a novel adaptive multi-relaxation time lattice Boltzmann method to simulate the fluid phase efficiently. The…

Computational Physics · Physics 2020-03-04 Christoph Rettinger , Ulrich Rüde

A classical reduced order model for dynamical problems involves spatial reduction of the problem size. However, temporal reduction accompanied by the spatial reduction can further reduce the problem size without losing accuracy much, which…

Numerical Analysis · Mathematics 2019-10-04 Youngsoo Choi , Peter Brown , Bill Arrighi , Robert Anderson

Sufficiently accurate finite state models, also called symbolic models or discrete abstractions, allow one to apply fully automated methods, originally developed for purely discrete systems, to formally reason about continuous and hybrid…

Optimization and Control · Mathematics 2011-11-03 Gunther Reißig

This paper presents a novel multi-robot coverage path planning (CPP) algorithm - aka SCoPP - that provides a time-efficient solution, with workload balanced plans for each robot in a multi-robot system, based on their initial states. This…

This research addresses the numerical simulation of the Boltzmann transport equation for semiconductor devices by proposing a multidimensional self-adaptive numerical simulation framework. This framework is applied to two important…

Numerical Analysis · Mathematics 2025-09-22 Zeyu Zhang , Xiaoyu Zhang , Zhigang Song , Qing Fang

High-order partial differential equations (PDEs) require derivative regularity that standard $C^0$ finite element infrastructures do not directly provide on unstructured meshes. We propose a mesh-intrinsic generalized finite element method…

Numerical Analysis · Mathematics 2026-04-28 Rong Tian

The Dirichlet process (DP) is a fundamental mathematical tool for Bayesian nonparametric modeling, and is widely used in tasks such as density estimation, natural language processing, and time series modeling. Although MCMC inference…

Machine Learning · Statistics 2013-04-09 Dan Lovell , Jonathan Malmaud , Ryan P. Adams , Vikash K. Mansinghka

In this work we propose and analyze a novel Hybrid High-Order discretization of a class of (linear and) nonlinear elasticity models in the small deformation regime which are of common use in solid mechanics. The proposed method is valid in…

Numerical Analysis · Mathematics 2017-07-10 Michele Botti , Daniele Di Pietro , Pierre Sochala

The numerical simulation of multiphase flows involving dispersed components with large scale disparities, such as the collisions between millimeter-sized bubbles and micron-sized mineral particles in flotation, poses a significant…

Fluid Dynamics · Physics 2026-05-21 Linfeng Jiang , Enrico Calzavarini , Dominik Krug

In this paper, two high order complex contour discretization methods are proposed to simulate wave propagation in locally perturbed periodic closed waveguides. As is well known the problem is not always uniquely solvable due to the…

Numerical Analysis · Mathematics 2022-07-27 Ruming Zhang

In this study, we present a simple and intuitive method for accelerating optimal Reeds-Shepp path computation. Our approach uses geometrical reasoning to analyze the behavior of optimal paths, resulting in a new partitioning of the state…

Robotics · Computer Science 2025-08-14 Ibrahim Ibrahim , Wilm Decré , Jan Swevers

This master thesis introduces the idea of dynamic cutoffs in molecular dynamics simulations, based on the distance between particles and the interface, and presents a solution for detecting interfaces in real-time. Our dynamic cutoff method…

Distributed, Parallel, and Cluster Computing · Computer Science 2015-02-12 Paul Springer

Sweeping is a commonly used procedure to explicitly solve the discrete ordinates equation, which itself is a common approximation of the neutron transport equation. To sweep through the computational domain, an ordering of the spatial cells…

Numerical Analysis · Mathematics 2018-06-22 Thomas Camminady , Martin Frank

We introduce a high-performance simulation framework that permits the semi-independent, task-based solution of sets of partial differential equations, typically manifesting as updates to a collection of `patches' in space-time. A hybrid…

Instrumentation and Methods for Astrophysics · Physics 2018-03-21 Å. Nordlund , J. P. Ramsey , A. Popovas , M. Kuffmeier

A common numerical task is to represent functions which are highly spatially anisotropic, and to solve differential equations related to these functions. One way such anisotropy arises is that information transfer along one spatial…

Numerical Analysis · Mathematics 2017-01-04 Ben F McMillan

We present a fast algorithm to solve nesting problems based on a semi-discrete representation of both the 2D non-convex pieces and the strip. The pieces and the strip are represented by a set of equidistant vertical line segments. The…

Computational Geometry · Computer Science 2021-08-27 Sahar Chehrazad , Dirk Roose , Tony Wauters

Discrete Fracture Network models are largely used for very large scale geological flow simulations. For this reason numerical methods require an investigation of tools for efficient parallel solutions on High Performance Computing systems.…

Numerical Analysis · Mathematics 2021-06-21 Stefano Berrone , Alice Raeli