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中国科学院计算技术研究所机构知识库
Institute of Computing Technology, Chinese Academy IR
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浏览/检索结果:
共22条,第1-10条
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作者:Shang, Honghui分Shang, Honghui
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Solving the Electronic Schr?dinger Equation by Pairing Tensor-Network State with Neural Network Quantum State
期刊论文
MATHEMATICS, 2024, 卷号: 12, 期号: 3, 页码: 16
作者:
Kan, Bowen
;
Tian, Yingqi
;
Xie, Daiyou
;
Wu, Yangjun
;
Fan, Yi
;
Shang, Honghui
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2024/05/20
quantum mechanics
neural network quantum state
high-performance simulations
strongly correlated materials
81-10
MPS-VQE: A variational quantum computational chemistry simulator with matrix product states
期刊论文
COMPUTER PHYSICS COMMUNICATIONS, 2024, 卷号: 294, 页码: 9
作者:
Xu, Zhiqian
;
Fan, Yi
;
Guo, Chu
;
Shang, Honghui
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2023/12/04
Quantum computing
Variational quantum eigensolver
Matrix product state
Quantum chemistry
Parallel scalability
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:3/0
  |  
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:10/0
  |  
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:8/0
  |  
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:8/0
  |  
提交时间:2023/12/04
OpenCL
DFPT
GPU
optimization
heterogeneous
Localized Resolution of Identity Approach to the Analytical Gradients of Random-Phase Approximation Ground-State Energy: Algorithm and Benchmarks
期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2022, 页码: 15
作者:
Tahir, Muhammad N.
;
Zhu, Tong
;
Shang, Honghui
;
Li, Jia
;
Blum, Volker
;
Ren, Xinguo
收藏
  |  
浏览/下载:21/0
  |  
提交时间:2022/12/07
Scaling Poisson Solvers on Many Cores via MMEwald
期刊论文
IEEE TRANSACTIONS ON PARALLEL AND DISTRIBUTED SYSTEMS, 2022, 卷号: 33, 期号: 8, 页码: 1888-1901
作者:
Wu, Mingchuan
;
Wu, Yangjun
;
Shang, Honghui
;
Liu, Ying
;
Cui, Huimin
;
Li, Fang
;
Duan, Xiaohui
;
Zhang, Yunquan
;
Feng, Xiaobing
收藏
  |  
浏览/下载:37/0
  |  
提交时间:2022/06/21
Optimization
Bandwidth
Supercomputers
Electric potential
Boundary conditions
Electrostatics
Silicon
Poisson solver
architecture-specific optimizations
many-core processor
Coupled Electronic and Anharmonic Structural Dynamics for Carrier Self-Trapping in Photovoltaic Antimony Chalcogenides
期刊论文
ADVANCED SCIENCE, 2022, 页码: 9
作者:
Tao, Weijian
;
Zhu, Leilei
;
Li, Kanghua
;
Chen, Chao
;
Chen, Yuzhong
;
Li, Yujie
;
Li, Xufeng
;
Tang, Jiang
;
Shang, Honghui
;
Zhu, Haiming
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2022/12/07
antimony chalcogenides
carrier self-trapping
electron-phonon interaction
Growth, Raman Scattering Investigation and Photodetector Properties of 2D SnP
期刊论文
SMALL, 2022, 页码: 9
作者:
Ding, Chuyun
;
Yao, Yuyu
;
Zhu, Leilei
;
Shang, Honghui
;
Xu, Peng
;
Liu, Xiaolin
;
Lin, Jia
;
Wang, Feng
;
Zhan, Xueying
;
He, Jun
;
Wang, Zhenxing
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2022/12/07
2D layered materials
chemical vapor deposition
field-effect transistors (FETs)
Raman scattering
SnP nanosheets