中国科学院计算技术研究所机构知识库

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	VD-NeRF: Visibility-Aware Decoupled Neural Radiance Fields for View-Consistent Editing and High-Frequency Relighting 期刊论文 IEEE TRANSACTIONS ON PATTERN ANALYSIS AND MACHINE INTELLIGENCE, 2025, 卷号: 47, 期号: 5, 页码: 3344-3357 作者:  Wu, Tong;  Sun, Jia-Mu;  Lai, Yu-Kun;  Gao, Lin 收藏  |  浏览/下载：7/0  |  提交时间：2025/06/25 Geometry  Lighting  Rendering (computer graphics)  Decoding  Image reconstruction  Feature extraction  Density functional theory  Image color analysis  Cameras  Training  Neural radiance fields  inverse rendering  editing
	Equivariance is essential, local representation is a need: A comprehensive and critical study of machine learning potentials for tobermorite phases 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2025, 卷号: 246, 页码: 14 作者:  Zhu, Keming;  Zhang, Zhibin 收藏  |  浏览/下载：28/0  |  提交时间：2024/12/06 Machine learning potential  Tobermorite  Density functional theory  Molecular dynamics
	Many-core acceleration of the first-principles all-electron quantum perturbation calculations 期刊论文 COMPUTER PHYSICS COMMUNICATIONS, 2021, 卷号: 267, 页码: 8 作者:  Shang, Honghui;  Duan, Xiaohui;  Li, Fang;  Zhang, Libo;  Xu, Zhiqian;  Liu, Kan;  Luo, Haiwen;  Ji, Yingrui;  Zhao, Wenxuan;  Xue, Wei;  Chen, Li;  Zhang, Yunquan 收藏  |  浏览/下载：59/0  |  提交时间：2021/12/01 Density-functional perturbation theory  Many-core architecture  Linear scaling  MPI  Numeric atomic orbitals
	Hydrogen evolution reaction on in-plane platinum and palladium dichalcogenides via single-atom doping 期刊论文 INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2021, 卷号: 46, 期号: 35, 页码: 18294-18304 作者:  Liu, Gang;  Li, Jingjing;  Dong, Chao;  Wu, Liyuan;  Liang, Dan;  Cao, Huawei;  Lu, Pengfei 收藏  |  浏览/下载：58/0  |  提交时间：2021/12/01 Density functional theory  Platinum and palladium dichalcogenides  Single-atom doping  Hydrogen evolution reaction
	Efficient parallel linear scaling method to get the response density matrix in all-electron real-space density-functional perturbation theory 期刊论文 COMPUTER PHYSICS COMMUNICATIONS, 2021, 卷号: 258, 页码: 11 作者:  Shang, Honghui;  Liang, WanZhen;  Zhang, Yunquan;  Yang, Jinlong 收藏  |  浏览/下载：56/0  |  提交时间：2021/12/01 Density-functional perturbation theory  Linear scaling  MPI  Numeric atomic orbitals  Density-function theory
	The dynamic parallel distribution algorithm for hybrid density-functional calculations in HONPAS package 期刊论文 COMPUTER PHYSICS COMMUNICATIONS, 2020, 卷号: 254, 页码: 9 作者:  Shang, Honghui;  Xu, Lei;  Wu, Baodong;  Qin, Xinming;  Zhang, Yunquan;  Yang, Jinlong 收藏  |  浏览/下载：70/0  |  提交时间：2020/12/10 Density-functional theory  Hartree-Fock  Hybrid functionals  Numeric atomic orbitals  Linear scaling  MPI