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Multiscale and inhomogeneous molecular systems are challenging topics in the field of molecular simulation. In particular, modeling biological systems in the context of multiscale simulations and exploring material properties are driving a…

Computational Physics · Physics 2017-12-06 Horacio V. Guzman , Christoph Junghans , Kurt Kremer , Torsten Stuehn

Turbulence in an incompressible fluid with and without a magnetic field as well as moderately compressible MHD turbulence are compared. For the magnetohydrodynamic (MHD) models the probability distribution functions of the velocity…

Astrophysics · Physics 2007-05-23 Nicholas Hall , G. Kowal , A. Lazarian , Jungyeon Cho

A high fidelity flow simulation for complex geometries for high Reynolds number ($Re$) flow is still very challenging, which requires more powerful computational capability of HPC system. However, the development of HPC with traditional CPU…

Computational Physics · Physics 2022-03-03 Chuangchao Ye , Pengjunyi Zhang , Rui Yan , Dejun Sun , Zhenhua Wan

Transformers have revolutionized deep learning and generative modeling to enable unprecedented advancements in natural language processing tasks and beyond. However, designing hardware accelerators for executing transformer models is…

Hardware Architecture · Computer Science 2024-08-08 Pratyush Dhingra , Janardhan Rao Doppa , Partha Pratim Pande

Design considerations for molecular dynamics algorithms capable of taking advantage of the computational power of a graphics processing unit (GPU) are described. Accommodating the constraints of scalable streaming-multiprocessor hardware…

Computational Physics · Physics 2011-01-27 D. C. Rapaport

As inverter-based resources (IBRs) penetrate power systems, the dynamics become more complex, exhibiting multiple timescales, including electromagnetic transient (EMT) dynamics of power electronic controllers and electromechanical dynamics…

Systems and Control · Electrical Eng. & Systems 2025-03-17 Kaiyang Huang , Min Xiong , Yang Liu , Kai Sun

Parallel code design is a challenging task especially when addressing petascale systems for massive parallel processing (MPP), i.e. parallel computations on several hundreds of thousands of cores. An in-house computational fluid dynamics…

Performance · Computer Science 2018-07-03 Jérôme Frisch , Ralf-Peter Mundani

Atomistic simulation drives scientific advances in modern material science and accounts for a significant proportion of wall time on High Performance Computing facilities. It is important that algorithms are efficient and implementations…

Distributed, Parallel, and Cluster Computing · Computer Science 2020-07-21 William Robert Saunders , James Grant , Eike Hermann Müller

Magnetised plasma turbulence pervades the universe and is likely to play an important role in a variety of astrophysical settings. Magnetohydrodynamics (MHD) provides the simplest theoretical framework in which phenomenological models for…

Plasma Physics · Physics 2012-07-23 Joanne Mason , Jean C. Perez , Stanislav Boldyrev , Fausto Cattaneo

Magnetohydrodynamics (MHD) generators present a promising pathway for clean energy conversion by directly transforming conductive fluids' kinetic energy into electricity. This study investigates the impact of electrode geometry…

Fluid Dynamics · Physics 2026-01-01 Arleen Natalie , Budiarso , Ridho Irwansyah

Current trends in parallel processors call for the design of efficient massively parallel algorithms for scientific computing. Parallel algorithms for Monte Carlo simulations of thermodynamic ensembles of particles have received little…

Computational Physics · Physics 2013-08-26 Joshua A. Anderson , Eric Jankowski , Thomas L. Grubb , Michael Engel , Sharon C. Glotzer

Heterogeneous multicore architectures are becoming increasingly popular due to their potential of achieving high performance and energy efficiency compared to the homogeneous multicore architectures. In such systems, the real-time…

Operating Systems · Computer Science 2014-05-29 Guangmo Tong , Cong Liu

Designing efficient and high-accuracy numerical methods for complex dynamic incompressible magnetohydrodynamics (MHD) equations remains a challenging problem in various analysis and design tasks. This is mainly due to the nonlinear coupling…

Numerical Analysis · Mathematics 2023-11-28 Xiaofei Guan , Boya Hu , Shipeng Mao , Xintong Wang , Zihao Yang

High-performance computing platforms are becoming more and more heterogeneous, which makes it very difficult for researchers and scientific software developers to keep up with the rapid changes on the hardware market. In this paper, the…

Mathematical Software · Computer Science 2018-09-27 Matthias Möller , Andrzej Jaeschke

This paper consists of three parts. The first part provides a unified programming model for heterogeneous computing with CPU and accelerator (like GPU, FPGA, Google TPU, Atos QPU, and more) technologies. To some extent, this new programming…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-05-31 Yuqing Xiong

We introduce a new model for the task mapping problem to aid in the systematic design of algorithms for heterogeneous systems including, but not limited to, CPUs, GPUs and FPGAs. A special focus is set on the communication between the…

Distributed, Parallel, and Cluster Computing · Computer Science 2026-04-15 Martin Wilhelm , Hanna Geppert , Anna Drewes , Thilo Pionteck

This paper presents a comprehensive comparison of three dominant parallel programming models in High Performance Computing (HPC): Message Passing Interface (MPI), Open Multi-Processing (OpenMP), and Compute Unified Device Architecture…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-06-19 Nizar ALHafez , Ahmad Kurdi

Numerical studies of the interplanetary "multiple magnetic clouds (Multi-MC)" are performed by a 2.5-dimensional ideal magnetohydrodynamic (MHD) model in the heliospheric meridional plane. Both slow MC1 and fast MC2 are initially emerged…

Space Physics · Physics 2009-05-08 Ming Xiong , Huinan Zheng , S. T. Wu , Yuming Wang , Shui Wang

Current GPU-accelerated supercomputers promise to enable large-scale simulations of turbulent flows. Lattice Boltzmann Methods (LBM) are particularly well-suited to fulfilling this promise due to their intrinsic compatibility with highly…

Computational Physics · Physics 2025-06-30 Adrian Kummerländer , Fedor Bukreev , Yuji Shimojima , Shota Ito , Mathias J. Krause

Simulations of nematohydrodynamics on graphics processing units (GPUs) are typically performed using double precision, which ensures accuracy but significantly increases computational cost. However, consumer-grade GPUs are optimized for…