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29-Billion Atoms Molecular Dynamics Simulation With Ab Initio Accuracy on 35 Million Cores of New Sunway Supercomputer 期刊论文
IEEE TRANSACTIONS ON COMPUTERS, 2025, 卷号: 74, 期号: 5, 页码: 1634-1648
作者:  Wang, Xun;  Meng, Xiangyu;  Guo, Zhuoqiang;  Li, Mingzhen;  Liu, Lijun;  Li, Mingfan;  Xiao, Qian;  Zhao, Tong;  Sun, Ninghui;  Tan, Guangming;  Jia, Weile
收藏  |  浏览/下载:2/0  |  提交时间:2025/06/25
Atoms  Accuracy  Supercomputers  Optimization  Artificial neural networks  Force  Training  Fitting  Predictive models  Nuclear power generation  High Performance Computing  Molecular Dynamics  DeePMD  Parallel Optimization  New Sunway Supercomputer  
10-Million Atoms Simulation of First-Principle Package LS3DF 期刊论文
JOURNAL OF COMPUTER SCIENCE AND TECHNOLOGY, 2024, 卷号: 39, 期号: 1, 页码: 45-62
作者:  Yan, Yu-Jin;  Li, Hai-Bo;  Zhao, Tong;  Wang, Lin-Wang;  Shi, Lin;  Liu, Tao;  Tan, Guang-Ming;  Jia, Wei-Le;  Sun, Ning-Hui
收藏  |  浏览/下载:17/0  |  提交时间:2024/12/06
single instruction multiple thread accelerator  electronic structure  high-performance computing  linearly scaling three-dimensional fragment (LS3DF)  
Optimizing the LINPACK Algorithm for Large-Scale PCIe-Based CPU-GPU Heterogeneous Systems 期刊论文
IEEE TRANSACTIONS ON PARALLEL AND DISTRIBUTED SYSTEMS, 2021, 卷号: 32, 期号: 9, 页码: 2367-2380
作者:  Tan, Guangming;  Shui, Chaoyang;  Wang, Yinshan;  Yu, Xianzhi;  Yan, Yujin
收藏  |  浏览/下载:60/0  |  提交时间:2021/12/01
Pipeline processing  Graphics processing units  Computer architecture  Supercomputers  Clustering algorithms  Programming  Optimization  LINPACK algorithm  software pipeline  performance model  heterogeneous computing  cluster