Multiscale universal interface: a concurrent framework for coupling heterogeneous solvers
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Publication:350122
DOI10.1016/J.JCP.2015.05.004zbMATH Open1349.76738arXiv1411.1293OpenAlexW1646498580WikidataQ60107936 ScholiaQ60107936MaRDI QIDQ350122FDOQ350122
Authors: Yu-Hang Tang, Shuhei Kudo, Xin Bian, Zhen Li, George Em Karniadakis 
Publication date: 5 December 2016
Published in: Journal of Computational Physics (Search for Journal in Brave)
Abstract: Concurrently coupled numerical simulations using heterogeneous solvers are powerful tools for modeling multiscale phenomena. However, major modifications to existing codes are often required to enable such simulations, posing significant difficulties in practice. In this paper we present a C++ library, i.e. the Multiscale Universal Interface (MUI), which is capable of facilitating the coupling effort for a wide range of multiscale simulations. The library adopts a header-only form with minimal external dependency and hence can be easily dropped into existing codes. A data sampler concept is introduced, combined with a hybrid dynamic/static typing mechanism, to create an easily customizable framework for solver-independent data interpretation. The library integrates MPI MPMD support and an asynchronous communication protocol to handle inter-solver information exchange irrespective of the solvers' own MPI awareness. Template metaprogramming is heavily employed to simultaneously improve runtime performance and code flexibility. We validated the library by solving three different multiscale problems, which also serve to demonstrate the flexibility of the framework in handling heterogeneous models and solvers. In the first example, a Couette flow was simulated using two concurrently coupled Smoothed Particle Hydrodynamics (SPH) simulations of different spatial resolutions. In the second example, we coupled the deterministic SPH method with the stochastic Dissipative Particle Dynamics (DPD) method to study the effect of surface grafting on the hydrodynamics properties on the surface. In the third example, we consider conjugate heat transfer between a solid domain and a fluid domain by coupling the particle-based energy-conserving DPD (eDPD) method with the Finite Element Method (FEM).
Full work available at URL: https://arxiv.org/abs/1411.1293
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- Coupling molecular dynamics and direct simulation Monte Carlo using a general and high-performance code coupling library
- A flexible multiscale algorithm based on an improved smoothed particle hydrodynamics method for complex viscoelastic flows
- Asynchronous coupling of hybrid models for efficient simulation of multiscale systems
- UNIVERCM: The UNIversal VERsatile Computational Model for Heterogeneous System Integration
- Supervised parallel-in-time algorithm for long-time Lagrangian simulations of stochastic dynamics: application to hydrodynamics
- Active learning of constitutive relation from mesoscopic dynamics for macroscopic modeling of non-Newtonian flows
- Analytical and computational studies of correlations of hydrodynamic fluctuations in shear flow
- Massively parallel location and exchange tools for unstructured meshes
- Multiscale parareal algorithm for long-time mesoscopic simulations of microvascular blood flow in zebrafish
- Parallel multiphysics coupling: algorithmic and computational performances
- Multi-resolution flow simulations by smoothed particle hydrodynamics via domain decomposition
- OpenFSI: a highly efficient and portable fluid-structure simulation package based on immersed-boundary method
- A Computational Architecture for Coupling Heterogeneous Numerical Models and Computing Coupled Derivatives
- A parallel multiscale simulation toolbox for coupling molecular dynamics and finite elements
- A seamless multiscale operator neural network for inferring bubble dynamics
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