Iterative methods for the force-based quasicontinuum approximation: analysis of a 1D model problem
From MaRDI portal
Publication:660253
DOI10.1016/J.CMA.2010.07.008zbMATH Open1230.74222arXiv0910.2013OpenAlexW2161980787MaRDI QIDQ660253FDOQ660253
M. Dobson, C. Ortner, Mitchell Luskin
Publication date: 1 February 2012
Published in: Computer Methods in Applied Mechanics and Engineering (Search for Journal in Brave)
Abstract: Force-based atomistic-continuum hybrid methods are the only known pointwise consistent methods for coupling a general atomistic model to a finite element continuum model. For this reason, and due to their algorithmic simplicity, force-based coupling methods have become a popular class of atomistic-continuum hybrid models as well as other types of multiphysics models. However, the recently discovered unusual stability properties of the linearized force-based quasicontinuum (QCF) approximation, especially its indefiniteness, present a challenge to the development of efficient and reliable iterative methods. We present analytic and computational results for the generalized minimal residual (GMRES) solution of the linearized QCF equilibrium equations. We show that the GMRES method accurately reproduces the stability of the force-based approximation and conclude that an appropriately preconditioned GMRES method results in a reliable and efficient solution method.
Full work available at URL: https://arxiv.org/abs/0910.2013
Recommendations
- Linear stationary iterative methods for the force-based quasicontinuum approximation
- Analysis of a force-based quasicontinuum approximation
- Stability, instability, and error of the force-based quasicontinuum approximation
- Sharp stability estimates for the force-based quasicontinuum approximation of homogeneous tensile deformation
- Iterative solution of the quasicontinuum equilibrium equations with continuation
Cites Work
- Numerical Optimization
- Parallel iterative methods for sparse linear systems
- Accuracy of quasicontinuum approximations near instabilities
- Title not available (Why is that?)
- An Introduction to Numerical Analysis
- Recent computational developments in Krylov subspace methods for linear systems
- A bridging domain method for coupling continua with molecular dynamics
- On Atomistic-to-Continuum Coupling by Blending
- On the application of the Arlequin method to the coupling of particle and continuum models
- Stability, instability, and error of the force-based quasicontinuum approximation
- An adaptive finite element approach to atomic-scale mechanics. -- The quasicontinuum method
- Analysis of a force-based quasicontinuum approximation
- An analysis of the quasicontinuum method
- Quasi-continuum orbital-free density-functional theory: a route to multi-million atom non-periodic DFT calculation
- An Optimal Order Error Analysis of the One-Dimensional Quasicontinuum Approximation
- Analysis of a One-Dimensional Nonlocal Quasi-Continuum Method
- Analysis of a prototypical multiscale method coupling atomistic and continuum mechanics
- A Quadrature-Rule Type Approximation to the Quasi-Continuum Method
- Analysis of a quasicontinuum method in one dimension
- Convergence Analysis of a Quasi‐Continuum Approximation for a Two‐Dimensional Material Without Defects
- An analysis of the effect of ghost force oscillation on quasicontinuum error
- Iterative methods for the force-based quasicontinuum approximation: analysis of a 1D model problem
- Iterative solution of the quasicontinuum equilibrium equations with continuation
Cited In (10)
- Lattice Green function methods for atomistic/continuum coupling: theory and data-sparse implementation
- Linear Stationary Iterative Methods for the Force-Based Quasicontinuum Approximation
- A Computational and Theoretical Investigation of the Accuracy of Quasicontinuum Methods
- Accuracy of quasicontinuum approximations near instabilities
- Iterative methods for the force-based quasicontinuum approximation: analysis of a 1D model problem
- Analysis of a quasicontinuum method in one dimension
- Theory-based benchmarking of the blended force-based quasicontinuum method
- A priori error analysis of two force-based atomistic/continuum models of a periodic chain
- Analysis of a Sinclair-Type Domain Decomposition Solver for Atomistic/Continuum Coupling
- QTT-finite-element approximation for multiscale problems. I: Model problems in one dimension
This page was built for publication: Iterative methods for the force-based quasicontinuum approximation: analysis of a 1D model problem
Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q660253)
