Quadrature-rule type approximations to the quasicontinuum method for long-range interatomic interactions

DOI10.1016/J.CMA.2009.10.015MaRDI QIDQ649280zbMATHOpenAlexFDO

Authors Yunzhi Zhang, Max Gunzburger

Publication date 30 November 2011

Published in Computer Methods in Applied Mechanics and Engineering (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/j.cma.2009.10.015

zbMATH Keywords

long-range interactionsatomistic modelsCoulomb potentialquasicontinuum methodquadrature-rule type approximation

Mathematics Subject Classification ID

Molecular, statistical, and kinetic theories in solid mechanics (74A25) Continuum models (systems of particles, etc.) arising in equilibrium statistical mechanics (82B21)

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Cites work

• scientific article; zbMATH DE number 5145091 (Why is no real title available?)
• scientific article; zbMATH DE number 4033243 (Why is no real title available?)
• An adaptive finite element approach to atomic-scale mechanics. -- The quasicontinuum method
• An analysis of the effect of ghost force oscillation on quasicontinuum error
• An analysis of the quasicontinuum method
• Analysis of a force-based quasicontinuum approximation
• Analysis of the local quasicontinuum method
• Convergence Analysis of a Quasi‐Continuum Approximation for a Two‐Dimensional Material Without Defects
• Critical and co-operative phenomena. III. A theory of melting and the structure of liquids
• Error Estimation and Atomistic-Continuum Adaptivity for the Quasicontinuum Approximation of a Frenkel–Kontorova Model
• Goal-oriented adaptive mesh refinement for the quasicontinuum approximation of a Frenkel-Kontorova model
• Iterative solution of the quasicontinuum equilibrium equations with continuation
• Quadrature-rule type approximations to the quasicontinuum method for long-range interatomic interactions

Cited in

(13)

• A field theoretical approach to the quasi-continuum method
• Accuracy of quasicontinuum approximations near instabilities
• Central summation in the quasicontinuum method
• Multiresolution molecular mechanics: statics
• A refinement indicator for adaptive quasicontinuum approaches for structural lattices
• Higher‐order quasicontinuum methods for elastic and dissipative lattice models: uniaxial deformation and pure bending
• A variational formulation of the quasicontinuum method based on energy sampling in clusters
• A quadrature-rule type approximation to the quasi-continuum method
• Quadrature-rule type approximations to the quasicontinuum method for long-range interatomic interactions
• Stability, instability, and error of the force-based quasicontinuum approximation
• Atom collocation method
• Multiresolution molecular mechanics: a unified and consistent framework for general finite element shape functions
• Multiresolution molecular mechanics: convergence and error structure analysis

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