86 PFLOPS Deep Potential Molecular Dynamics simulation of 100 million atoms with ab initio accuracy

被引：0

作者：

Lu, Denghui ^{[1
]}

Wang, Han ^{[2
]}

Chen, Mohan ^{[1
]}

Lin, Lin ^{[3
,4
]}

Car, Roberto ^{[5
]}

E, Weinan ^{[5
]}

Jia, Weile ^{[3
]}

Zhang, Linfeng ^{[5
]}

机构：

[1] CAPT, HEDPS, College of Engineering, Peking University, China

[2] Laboratory of Computational Physics, Institute of Applied Physics and Computational Mathematics, China

[3] University of California, Berkeley, United States

[4] Lawrence Berkeley National Laboratory, United States

[5] Princeton University, United States

来源：

Computer Physics Communications | 2021年 / 259卷

关键词：

Molecular dynamics;

D O I：

暂无

中图分类号：

学科分类号：

摘要：

引用

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