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The extraction of inhomogeneous 3-dimensional densities around tagged solutes from molecular simulations is known to have a very high computational cost because this is traditionally performed by collecting histograms, with each discrete…

Chemical Physics · Physics 2019-08-22 Samuel W. Coles , Daniel Borgis , Rodolphe Vuilleumier , Benjamin Rotenberg

The dynamic behavior of jointed assemblies exhibiting friction nonlinearities features amplitude-dependent dissipation and stiffness. To develop numerical simulations for predictive and design purposes, macro-scale High Fidelity Models…

Computational Engineering, Finance, and Science · Computer Science 2022-04-27 Ahmed Amr Morsy , Mariella Kast , Paolo Tiso

We investigate the feasibility of simulating different model Hamiltonians used in high-temperature superconductivity. We briefly discuss the most common models and then focus on the simulation of the so-called t-J-U Hamiltonian using…

Quantum Physics · Physics 2007-05-23 Alexander Klein , Dieter Jaksch

This study addresses the challenge of simulating realistic particle systems by proposing a novel particle decomposition scheme that improves the parallel performance of surface resolved particle simulations. Realistic particle systems often…

Fluid Dynamics · Physics 2024-03-21 J. E. Marquardt , N. Hafen , M. J. Krause

We present a quantum computational framework using Hamiltonian Truncation (HT) for simulating real-time scattering processes in $(1+1)$-dimensional scalar $\phi^4$ theory. Unlike traditional lattice discretisation methods, HT approximates…

Quantum Physics · Physics 2025-05-08 James Ingoldby , Michael Spannowsky , Timur Sypchenko , Simon Williams , Matthew Wingate

How heterogeneous multiscale methods (HMM) handle fluctuations acting on the slow variables in fast-slow systems is investigated. In particular, it is shown via analysis of central limit theorems (CLT) and large deviation principles (LDP)…

Probability · Mathematics 2016-01-12 David Kelly , Eric Vanden-Eijnden

While for many years the lattice, electronic and magnetic complexity of high-temperature superconductors (HTS) has been considered responsible for hindering the search of the mechanism of HTS now the complexity of HTS is proposed to be…

Superconductivity · Physics 2012-06-13 Antonio Bianconi , Nicola Poccia

We discuss the relevance of several finite-element formulations for nonlinear systems containing high-temperature superconductors (HTS) and ferromagnetic materials (FM), in the context of a 3D motor pole model. The formulations are…

Accelerator Physics · Physics 2024-06-25 Julien Dular , Kévin Berger , Christophe Geuzaine , Benoît Vanderheyden

Due to decelerating gains in single-core CPU performance, computationally expensive simulations are increasingly executed on highly parallel hardware platforms. Agent-based simulations, where simulated entities act with a certain degree of…

Multiagent Systems · Computer Science 2018-07-04 Jiajian Xiao , Philipp Andelfinger , David Eckhoff , Wentong Cai , Alois Knoll

Simulating from the multivariate truncated normal distribution (MTN) is required in various statistical applications yet remains challenging in high dimensions. Currently available algorithms and their implementations often fail when the…

Computation · Statistics 2022-10-04 Zhenyu Zhang , Andrew Chin , Akihiko Nishimura , Marc A. Suchard

This article addresses the research question if and how the finite cell method, an embedded domain finite element method of high order, may be used in the simulation of metal deposition to harvest its computational efficiency. This…

Numerical Analysis · Mathematics 2018-09-26 Ali Özcan , Stefan Kollmannsberger , John N. Jomo , Ernst Rank

As supercomputers' complexity has grown, the traditional boundaries between processor, memory, network, and accelerators have blurred, making a homogeneous computer model, in which the overall computer system is modeled as a continuous…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-05-10 Martin Karp , Niclas Jansson , Philipp Schlatter , Stefano Markidis

Simulation in media with multiple continua where each continuum interacts with every other is often challenging due to multiple scales and high contrast. One needs some types of model reduction. One of the approaches is multi-continuum…

Numerical Analysis · Mathematics 2019-06-12 Jun Sur Richard Park , Viet Ha Hoang

The life of the modern world essentially depends on the work of the large artificial homogeneous networks, such as wired and wireless communication systems, networks of roads and pipelines. The support of their effective continuous…

Optimization and Control · Mathematics 2017-01-25 Dmitry Yu. Ignatov , Alexander N. Filippov , Andrey D. Ignatov , Xuecang Zhang

In order to transport sufficiently high current, high-temperature superconductor (HTS) tapes are assembled in cable structures of different forms. In such cables, the tapes are tightly packed and have a strong electromagnetic interaction.…

Superconductivity · Physics 2018-07-04 Víctor M. R. Zermeño , Salman Quaiyum , Francesco Grilli

Traditional dynamic security assessment faces challenges as power systems are experiencing a transformation to inverter-based-resource (IBR) dominated systems, for which electromagnetic transient (EMT) dynamics have to be considered.…

Dynamical Systems · Mathematics 2023-02-21 Kaiyang Huang , Min Xiong , Yang Liu , Kai Sun , Feng Qiu

X-ray absorption spectroscopy (XAS) is a leading technique for understanding structural changes in advanced battery materials such as lithium-excess cathodes. However, extracting critical information like oxidation states from the…

Time series aggregation (TSA) aims to construct temporally aggregated optimization models that accurately represent the output space of their full-scale counterparts while using a significantly reduced temporal dimensionality. This paper…

Optimization and Control · Mathematics 2026-03-16 Thomas Klatzer , David Cardona-Vasquez , Luca Santosuosso , Sonja Wogrin

Thermomechanical stress induced by through-silicon vias (TSVs) plays an important role in the performance and reliability analysis of 2.5D/3D ICs. While the finite element method (FEM) adopted by commercial software can provide accurate…

Computational Engineering, Finance, and Science · Computer Science 2024-11-20 Tianxiang Zhu , Qipan Wang , Yibo Lin , Runsheng Wang , Ru Huang

Accurate simulation of wave propagation in complex acoustic materials is crucial for applications in sound design, noise control, and material engineering. Traditional numerical solvers, such as finite element methods, are computationally…

Machine Learning · Computer Science 2025-10-14 Riccardo Fosco Gramaccioni , Christian Marinoni , Fabrizio Frezza , Aurelio Uncini , Danilo Comminiello
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