A Vectorized Algorithm for Molecular Dynamics of Short Range Interacting Particles

Details A Vectorized Algorithm for Molecular Dynamics of Short Range Interacting Particles A Vectorized Algorithm for Molecular Dynamics of Short Range Interacting Particles

1993-07-18

arxiv.org/abs/cond-mat/9307035v2

J. Mod. Phys. C, Vol. 4, 1049 (1993)

Physics

Condensed Matter

9 pages, 6 figures, Latex

Scientific paper

10.1142/S0129183193000811

We report on a lattice based algorithm, completely vectorized for molecular dynamics simulations. Its algorithmic complexity is of the order O(N), where $N$ is the number of particles. The algorithm works very effectively when the particles have short range interaction, but it is applicable to each kind of interaction. The code was tested on a Cray ymp el in a simulation of flowing granular material.

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