"Fast plane wave density functional theory molecular dynamics calculations ..."

Weile Jia et al. (2013)

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DOI: 10.1016/J.JCP.2013.05.005

access: closed

type: Journal Article

metadata version: 2020-02-19

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Weile Jia, Jiyun Fu, Zongyan Cao, Long Wang, Xuebin Chi, Weiguo Gao, Lin-Wang Wang:
Fast plane wave density functional theory molecular dynamics calculations on multi-GPU machines. J. Comput. Phys. 251: 102-115 (2013)

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