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Event-driven molecular dynamics in parallel
2004
Journal of Computational Physics
Although event-driven algorithms have been shown to be far more efficient than time-driven methods such as conventional molecular dynamics, they have not become as popular. The main obstacle seems to be the difficulty of parallelizing event-driven molecular dynamics. Several basic ideas have been discussed in recent years, but to our knowledge no complete implementation has been published yet. In this paper we present a parallel event-driven algorithm including dynamic load-balancing, which can
doi:10.1016/j.jcp.2003.08.009
fatcat:f53bcwpijrfexauvi4fvhi3way