Article ID Journal Published Year Pages File Type
498060 Computer Methods in Applied Mechanics and Engineering 2014 19 Pages PDF
Abstract

•Development of a force-based blended atomistic-to-continuum coupling method.•Theoretical optimization of the blending function and mesh refinement.•Numerical experiments that validate the predictions for lattice stability and strain.•Numerical demonstration of the superior accuracy of the blended force-based method.

We formulate an atomistic-to-continuum coupling method based on blending atomistic and continuum forces. Our precise choice of blending mechanism is informed by theoretical predictions. We present a range of numerical experiments studying the accuracy of the scheme, focusing in particular on its stability. These experiments confirm and extend the theoretical predictions, and demonstrate a superior accuracy of B-QCF over energy-based blending schemes.

Related Topics
Physical Sciences and Engineering Computer Science Computer Science Applications
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