中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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Distributed Multi-GPU Ab Initio Density Matrix Renormalization Group Algorithm with Applications to the P-Cluster of Nitrogenase 期刊论文  OAI收割
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2024, 卷号: 20, 期号: 2, 页码: 775-786
作者:  
Xiang, Chunyang;  Jia, Weile;  Fang, Wei-Hai;  Li, Zhendong
  |  收藏  |  浏览/下载:4/0  |  提交时间:2024/05/20
DeePMD-kit v2: A software package for deep potential models 期刊论文  OAI收割
JOURNAL OF CHEMICAL PHYSICS, 2023, 卷号: 159, 期号: 5, 页码: 24
作者:  
Zeng, Jinzhe;  Zhang, Duo;  Lu, Denghui;  Mo, Pinghui;  Li, Zeyu
  |  收藏  |  浏览/下载:32/0  |  提交时间:2023/12/04
Gpu implementation of the linear scaling three dimensional fragment method for large scale electronic structure calculations 期刊论文  iSwitch采集
Computer physics communications, 2017, 卷号: 211, 页码: 8-15
作者:  
Jia, Weile;  Wang, Jue;  Chi, Xuebin;  Wang, Lin-Wang
收藏  |  浏览/下载:46/0  |  提交时间:2019/05/09
SGO: A fast engine for ab initio atomic structure global optimization by differential evolution 期刊论文  OAI收割
Computer Physics Communications, 2017, 卷号: 219, 页码: 35–44
作者:  
Zhanghui Chen;  Weile Jia;  Xiangwei Jiang;  Shu-Shen Li;  Lin-Wang Wang
收藏  |  浏览/下载:24/0  |  提交时间:2018/06/15