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Molecular Dynamics Results

Monte Carlo simulations which suffer from non-ergodic sampling contain little physical meaning. In contrast, constant energy Molecular Dynamics (MD) simulations can associate real time scales with finite non-ergodic trajectories restricted to well-defined regions of configuration space. To illustrate this we start with BzAr tex2html_wrap_inline1451 .





Matt Hodges & Andreas Dullweber
Fri Oct 20 09:28:06 BST 1996