SC²S Colloquium - Mai 19, 2011

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Date: Mai 19, 2011
Room: 02.07.023
Time: 15:00 pm, s.t.

Johannes Weißl: Development of an efficient method for the simulation of molecular long-range interactions (MA)

The Molecular Dynamics simulation "MarDyn" currently only calculates short-range interactions between particles. To more precisely simulate potentials which take effect over long distances, two well known algorithms were selected (FMM and Barnes-Hut). They have to be adapted to our MD-setting and compared for accuracy and efficiency.