Molecular dynamics simulations with many-body potentials on multiple GPUs - The implementation, package and performance - researchr publication

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Qing Hou, Min Li, Yulu Zhou, Jiechao Cui, Zhenguo Cui, Jun Wang. Molecular dynamics simulations with many-body potentials on multiple GPUs - The implementation, package and performance. Computer Physics Communications, 184(9):2091-2101, 2013. [doi]

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