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High Energy Physics (HEP) experiments are making increasing use of GPUs and GPU dominated High Performance Computer facilities. Both the software and hardware of these systems are rapidly evolving, creating challenges for experiments to…

High Energy Physics - Experiment · Physics 2025-05-15 Mohammad Atif , Pengfei Ding , Ka Hei Martin Kwok , Charles Leggett

In this work, possibility of simulating biological organs in realtime using the Boundary Element Method (BEM) is investigated. Biological organs are assumed to follow linear elastostatic material behavior, and constant boundary element is…

Computational Engineering, Finance, and Science · Computer Science 2014-02-11 Kirana Kumara P

Adaptive finite elements combined with geometric multigrid solvers are one of the most efficient numerical methods for problems such as the instationary Navier-Stokes equations. Yet despite their efficiency, computations remain expensive…

Numerical Analysis · Mathematics 2025-12-23 Manuel Liebchen , Robert Jendersie , Utku Kaya , Christian Lessig , Thomas Richter

In this paper, we present algorithms and implementations for the end-to-end GPU acceleration of matrix-free low-order-refined preconditioning of high-order finite element problems. The methods described here allow for the construction of…

Mathematical Software · Computer Science 2023-06-05 Will Pazner , Tzanio Kolev , Jean-Sylvain Camier

In this paper, we present results obtained using QMCTorch, a modular framework for real-space Quantum Monte Carlo (QMC) simulations of small molecular systems. Built on the popular deep learning library PyTorch, QMCTorch is GPU-native and…

Chemical Physics · Physics 2025-06-12 Nicolas Renaud

Particle accelerator modeling is an important field of research and development, essential to investigating, designing and operating some of the most complex scientific devices ever built. Kinetic simulations of relativistic, charged…

Accelerator Physics · Physics 2024-05-02 Ryan T. Sandberg , Remi Lehe , Chad E. Mitchell , Marco Garten , Andrew Myers , Ji Qiang , Jean-Luc Vay , Axel Huebl

This article presents an open-source Python package for simulating micro-thermoelectric generators, based on the work by D. Beretta et al. (Sustainable Energy Fuels, 2017). Featuring a user-friendly graphical user interface and robust…

Mesoscale and Nanoscale Physics · Physics 2025-10-21 D. Beretta

To execute scientific computing programs such as deep learning at high speed, GPU acceleration is a powerful option. With the recent advancements in web technologies, interfaces like WebGL and WebGPU, which utilize GPUs on the client side…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-03-04 Masatoshi Hidaka , Tatsuya Harada

The realisation of precision cardiology requires novel techniques for the non-invasive characterisation of individual patients' cardiac function to inform therapeutic and diagnostic decision-making. The electrocardiogram (ECG) is the most…

Tissues and Organs · Quantitative Biology 2021-12-09 Julia Camps , Brodie Lawson , Christopher Drovandi , Ana Minchole , Zhinuo Jenny Wang , Vicente Grau , Kevin Burrage , Blanca Rodriguez

Sourceless efficiency calibration of high-purity germanium (HPGe) detectors can provide accurate detector-response information without experiments using radioactive calibration sources, offering advantages in both convenience and safety. In…

Instrumentation and Detectors · Physics 2026-05-26 Kainan Zhang , Shuchang Yan , Zhen Wu , Hui Zhang , Rui Qiu , Junli Li

Conventional kernel-based machine learning models for ab initio potential energy surfaces, while accurate and convenient in small data regimes, suffer immense computational cost as training set sizes increase. We introduce QML-Lightning, a…

Chemical Physics · Physics 2022-12-21 Nicholas J. Browning , Felix A. Faber , O. Anatole von Lilienfeld

This paper presents refinements to the execution-cache-memory performance model and a previously published power model for multicore processors. The combination of both enables a very accurate prediction of performance and energy…

Performance · Computer Science 2018-07-09 Johannes Hofmann , Georg Hager , Dietmar Fey

Recent advancements in hardware accelerators such as Tensor Processing Units (TPUs) speed up computation time relative to Central Processing Units (CPUs) not only for machine learning but, as demonstrated here, also for scientific modeling…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-04-22 Damien Pierce , R. Lily Hu , Yusef Shafi , Anudhyan Boral , Vladimir Anisimov , Sella Nevo , Yi-fan Chen

Graphics processing units have been extensively used to accelerate classical molecular dynamics simulations. However, there is much less progress on the acceleration of force evaluations for many-body potentials compared to pairwise ones.…

Computational Physics · Physics 2017-06-27 Zheyong Fan , Wei Chen , Ville Vierimaa , Ari Harju

There is a need for open-source libraries in emission tomography that (i) use modern and popular backend code to encourage community contributions and (ii) offer support for the multitude of reconstruction techniques available in recent…

High Energy Physics (HEP) needs a huge amount of computing resources. In addition data acquisition, transfer, and analysis require a well developed infrastructure too. In order to prove new physics disciplines it is required to higher the…

Distributed, Parallel, and Cluster Computing · Computer Science 2019-08-14 Gábor Bíró , Gergely Gábor Barnaföldi , Endre Futó

We present PyTorch Connectomics (PyTC), an open-source deep-learning framework for the semantic and instance segmentation of volumetric microscopy images, built upon PyTorch. We demonstrate the effectiveness of PyTC in the field of…

Image and Video Processing · Electrical Eng. & Systems 2021-12-14 Zudi Lin , Donglai Wei , Jeff Lichtman , Hanspeter Pfister

This paper analyzes different ways to simulate electromagnetically three-core armored cables in 3D by means of the finite element method. Full periodic models, as lengthy as 36 m, are developed to evaluate the accuracy when simulating only…

Systems and Control · Electrical Eng. & Systems 2024-01-24 Juan Carlos del-Pino-López , Marius Hatlo , Pedro Cruz-Romero

An efficient solver for the three dimensional free-space Poisson equation is presented. The underlying numerical method is based on finite Fourier series approximation. While the error of all involved approximations can be fully controlled,…

Computational Physics · Physics 2017-10-18 Lukas Exl

The heart is a vital organ that relies on the orchestrated propagation of electrical stimuli to coordinate each heart beat. Abnormalities in the heart's electrical behaviour can be managed with a cardiac pacemaker. Recently, the closed-loop…

Systems and Control · Computer Science 2016-03-21 Eugene Yip , Sidharta Andalam , Partha S. Roop , Avinash Malik , Mark Trew , Weiwei Ai , Nitish Patel