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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…

计算物理 · 物理学 2017-01-23 Paul Springer , Ahmed E. Ismail , Paolo Bientinesi

High-order Discontinuous Galerkin (DG) methods offer excellent accuracy for turbulent flow simulations, especially when implemented on GPU-oriented architectures that favor very high polynomial orders. On modern GPUs, high-order polynomial…

Direct numerical simulations (DNS) of microscale fluid-structure interactions (mFSI) in multicomponent multiphase flows pose many challenges, including the thermodynamic consistency of multiphysics couplings, tracking of moving interfaces,…

流体动力学 · 物理学 2025-08-08 Min Gao , Zhihao Li , Xinpeng Xu

This paper describes a massively parallel code for a state-of-the art thermal lattice- Boltzmann method. Our code has been carefully optimized for performance on one GPU and to have a good scaling behavior extending to a large number of…

分布式、并行与集群计算 · 计算机科学 2017-03-02 E. Calore , A. Gabbana , J. Kraus , E. Pellegrini , S. F. Schifano , R. Tripiccione

A numerical method based upon the immersed boundary technique for the fluid-solid coupling and on a soft-sphere approach for solid-solid contact is used to perform direct numerical simulation of the flow-induced motion of a thick bed of…

流体动力学 · 物理学 2014-10-01 Aman G. Kidanemariam , Markus Uhlmann

Modeling the transport of deformable capsules under different flow regimens is crucial in a variety of fields, including oil rheology, blood flow and the dispersion of pollutants. The aim of this study is twofold. Firstly, a combined…

流体动力学 · 物理学 2019-03-11 A. Coclite , S. Ranaldo , M. D. De Tullio , P. Decuzzi , G. Pascazio

We present FlowPM, a Particle-Mesh (PM) cosmological N-body code implemented in Mesh-TensorFlow for GPU-accelerated, distributed, and differentiable simulations. We implement and validate the accuracy of a novel multi-grid scheme based on…

宇宙学与河外天体物理 · 物理学 2020-10-23 Chirag Modi , Francois Lanusse , Uros Seljak

Coarse-grained modeling and efficient computer simulations are critical to the study of complex molecular processes with many degrees of freedom and multiple spatiotemporal scales. Variational implicit-solvent model (VISM) for biomolecular…

化学物理 · 物理学 2022-10-26 Shuang Liu , Zirui Zhang , Li-Tien Cheng , Bo Li

A simulation framework based on the level-set and the immersed boundary methods (LS-IBM) has been developed for reactive transport problems in porous media involving a moving solid-fluid interface. The interface movement due to surface…

流体动力学 · 物理学 2023-04-13 Mehrdad Yousefzadeh , Yinuo Yao , Ilenia Battiato

Fluid-particle systems are highly sensitive to particle morphologies. While many attempts have been made on shape descriptors and coupling schemes, how to simulate the particle-particle and particle-fluid interactions with a balance between…

计算工程、金融与科学 · 计算机科学 2023-02-01 Yifeng Zhao , Pei Zhang , Liang Lei , S. A. Galindo-Torres , Stan Z. Li

Solute transport in fluid-particle systems is a fundamental process in numerous scientific and engineering disciplines. The simulation of it necessitates the consideration of solid particles with intricate shapes and sizes. To address this…

计算工程、金融与科学 · 计算机科学 2023-08-10 Yifeng Zhao , Pei Zhang , Stan Z. Li , S. A. Galindo-Torres

Rod bundle flows are commonplace in nuclear engineering, and are present in light water reactors (LWRs) as well as other more advanced concepts. Inhomogeneities in the bundle cross section can lead to complex flow phenomena, including…

流体动力学 · 物理学 2020-07-02 Adam Kraus , Elia Merzari , Thomas Norddine , Oana Marin , Sofiane Benhamadouche

High-fidelity simulations of unsteady fluid flow are now possible with advancements in high-performance computing hardware and software frameworks. Since computational fluid dynamics (CFD) computations are dominated by linear algebraic…

分布式、并行与集群计算 · 计算机科学 2024-02-28 Rahul Sundar , Dipanjan Majumdar , Chhote Lal Shah , Sunetra Sarkar

This paper introduces a random-batch molecular dynamics (RBMD) package for fast simulations of particle systems at the nano/micro scale. Different from existing packages, the RBMD uses random batch methods for nonbonded interactions of…

A upscaled lattice Boltzmann method (LBM) for flow simulations in heterogeneous porous media, at both pore and Darcy scales, is proposed in this paper. In the micro-scale simulations, we model flows using LBM with the modified Guo et al.…

计算物理 · 物理学 2013-12-03 Jun Li , Donald Brown

The complexity of the interactions between the constituent granular and liquid phases of a suspension requires an adequate treatment of the constituents themselves. A promising way for numerical simulations of such systems is given by…

软凝聚态物质 · 物理学 2015-09-09 A. Leonardi , F. K. Wittel , M. Mendoza , H. J. Herrmann

Solving flow-related inverse problems such as topology optimization problems is intricate but significant in various engineering fields. The lattice Boltzmann method (LBM) and the related adjoint method are highly suitable to perform…

数值分析 · 数学 2025-06-10 Ji-Wang Luo , Li Chen , Kentaro Yaji , Wen-Quan Tao

To acquire the ability to numerically study the rheology of particulate two-phase flows that lack scale separation, we present a general method to average or coarse-grain the equations of motion of a mixture of a continuous fluid of…

流体动力学 · 物理学 2026-01-22 Thomas Pähtz , Yulan Chen , Rui Zhu , Katharina Tholen , Zhiguo He

Molecular dynamics facilitates the simulation of a complex system to be analyzed at molecular and atomic levels. Simulations can last a long period of time, even months. Due to this cause the graphics processing units (GPUs) and multi-core…

计算物理 · 物理学 2021-02-02 Iuliana Marin , Nicolae Goga , Maria Goga

We explore a novel simulation route for Plasma Wakefield Acceleration (PWFA) by using the computational method known as the Lattice Boltzmann Method (LBM). LBM is based on a discretization of the continuum kinetic theory while assuring the…

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