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F. Gygi, E. W. Draeger, B. R. de Supinski, R. K. Yates, Franz Franchetti, Stefan Kral, Juergen Lorenz, Christoph W. Ueberhuber, J. A. Gunnels and J. C. Sexton (Proc. Supercomputing (SC), 2005)
Large-Scale First-Principles Molecular Dynamics Simulations on the BlueGene/L Platform Using the Qbox Code
Comment: Gordon Bell Prize 2005 Finalist