中国科学院计算技术研究所机构知识库

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发表日期：2023

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	Differentiable matrix product states for simulating variational quantum computational chemistry 期刊论文 QUANTUM, 2023, 卷号: 7, 页码: 15 作者:  Guo, Chu;  Fan, Yi;  Xu, Zhiqian;  Shang, Honghui 收藏  |  浏览/下载：2/0  |  提交时间：2024/05/20
	Redesigning OpenKMC for Multi-Component Trillion-Atom Simulations on the New Sunway Supercomputer 期刊论文 IEEE TRANSACTIONS ON PARALLEL AND DISTRIBUTED SYSTEMS, 2023, 卷号: 34, 期号: 7, 页码: 1997-2010 作者:  Xu, Lei;  Shang, Honghui;  Chen, Xin;  Zhang, Yunquan;  Wang, Lifang;  Gao, Xingyu;  Song, Haifeng 收藏  |  浏览/下载：8/0  |  提交时间：2023/12/04 Metals  Computational modeling  Monte Carlo methods  Kinetic theory  Aging  Steel  Silicon  Atomic kinetic Monte Carlo  many-core processor  scalability
	OpenCL-accelerated first-principles calculations of all-electron quantum perturbations on HPC resources (vol 11, 1156891, 2023) 期刊论文 FRONTIERS IN CHEMISTRY, 2023, 卷号: 11, 页码: 1 作者:  Wu, Zhikun;  Shang, Honghui;  Wu, Yangjun;  Zhang, Zhongcheng;  Liu, Ying;  Zhang, Yuyang;  Ouyang, Yucheng;  Cui, Huimin;  Feng, Xiaobing 收藏  |  浏览/下载：7/0  |  提交时间：2023/12/04 OpenCL  DFPT  GPU  optimization  heterogeneous
	OpenCL-accelerated first-principles calculations of all-electron quantum perturbations on HPC resources 期刊论文 FRONTIERS IN CHEMISTRY, 2023, 卷号: 11, 页码: 15 作者:  Wu, Zhikun;  Shang, Honghui;  Wu, Yangjun;  Zhang, Zhongcheng;  Liu, Ying;  Zhang, Yuyang;  Ouyang, Yucheng;  Cui, Huimin;  Feng, Xiaobing 收藏  |  浏览/下载：7/0  |  提交时间：2023/12/04 OpenCL  DFPT  GPU  optimization  heterogeneous