Based on previous work of one of the authors, we define “coarse grained” local observables
for temperature and stress, which are thermodynamically consistent and continuously …

With the advent of nanotechnology, predictive simulations of nanoscale systems have
become in great demand. In some cases, nanoscale systems can be simulated directly at …

As motivation builds to consider mechanics of nanometer scale objects, it is increasingly
advantageous to implement models with finer resolution than standard continuum …

Macroscale “continuum” level predictions are made by a new way to construct
computationally efficient “wrappers” around fine-scale, microscopic, detailed descriptions of …

We develop a technique for simulation of the mechanics of micron-scale solid systems:
coarse-grained molecular dynamics (CGMD). It captures the important atomistic effects …

Coarse-grained molecular dynamics (CGMD) is a technique developed as a concurrent
multiscale model that couples conventional molecular dynamics (MD) to a more coarse …

Basically, there exist two fundamental physical models that provide foundations for almost
all material behavioral simulations: microscopic discrete atomistic models and macroscopic …

We propose a new multiscale method that couples molecular dynamics simulations (MD) at
the atomic scale and finite element simulations (FE) at the continuum regime. By …

In this paper, we present all necessary generalisations to extend the bridging scale, a finite-
temperature multiple scale method which couples molecular dynamics (MD) and finite …

Coarse-grained representations of matter are required for the investigation of material
phenomena that occur simultaneously at different length and time scales. Multiple scales …