A space–time multilevel method for molecular dynamics simulations
نویسندگان
چکیده
منابع مشابه
A Space-Time Multilevel Method For Molecular Dynamics Simulations
We present a novel multiscale approach for molecular dynamics simulations. It is aimed at bridging discrete scales with either coarse grained discrete or continuum scales. The method consists of the waveform relaxation scheme aimed at capturing the high frequency response of atomistic vibrations and a coarse scale solution in space and time aimed at resolving smooth features (in both space and ...
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ژورنال
عنوان ژورنال: Computer Methods in Applied Mechanics and Engineering
سال: 2006
ISSN: 0045-7825
DOI: 10.1016/j.cma.2006.02.006