De Novo Ultrascale Atomistic Simulations On High-End Parallel Supercomputers

Aiichiro Nakano, Rajiv K. Kalia, Ken-ichi Nomura, Ashish Sharma, Priya Vashishta, Fuyuki Shimojo, Adri C. T. van Duin, William A. Goddard, Rupak Biswas, Deepak Srivastava, Lin H. Yang. De Novo Ultrascale Atomistic Simulations On High-End Parallel Supercomputers. IJHPCA, 22(1):113-128, 2008. [doi]

Abstract

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