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Deep-Learning Potential Molecular Dynamics Study on Nanopolycrystalline Al-Er Alloys: Effects of Er Concentration, Grain Boundary Segregation, and Grain Size on Plastic Deformation 期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2025, 页码: 12
作者:  Chang, Zhen;  Feng, Li;  Xue, Hong-Tao;  Yang, Yan-Hong;  Ren, Jun-Qiang;  Tang, Fu-Ling;  Lu, Xue-Feng;  Li, Jun-Chen
收藏  |  浏览/下载：2/0  |  提交时间：2025/04/27
Highly printable, strong, and ductile ordered intermetallic alloy 期刊论文
NATURE COMMUNICATIONS, 2025, 卷号: 16, 期号: 1, 页码: 9
作者:  Zhou, Yinghao;  Xiao, Weicheng;  Wang, Dawei;  Tang, Xu;  Shen, Zheling;  Li, Weipeng;  Zhang, Jun;  Zhao, Shijun;  Luan, Junhua;  An, Zibing;  Shi, Rongpei;  Yan, Ming;  Han, Xiaodong.;  Liu, C. T.;  Zhao, Yilu;  Yang, Tao
收藏  |  浏览/下载：2/0  |  提交时间：2025/04/27
In-situ investigating the heterogeneous tensile deformation behavior of near β titanium alloys 期刊论文
MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING, 2025, 卷号: 921, 页码: 14
作者:  Liu, Wenhao;  Luo, Hengjun;  Zhou, Lvjun;  Qin, Yulin;  Tang, Jiafeng;  Zhang, Ning;  Deng, Hao;  Chen, Longqing;  Sun, Tao;  Zhu, Jun;  Yin, Ming
收藏  |  浏览/下载：2/0  |  提交时间：2025/04/27
Titanium alloys  In-situ EBSD  Plastic deformation  Anisotropy  Slip  
Layered metal carbo-selenide Nb2CSe2 with van der Waals interlayer coupling 期刊论文
JOURNAL OF ADVANCED CERAMICS, 2025, 卷号: 14, 期号: 1, 页码: 10
作者:  Wang, Junchao;  Cheng, Renfei;  Hu, Tao;  Tang, Xinyue;  Liang, Yan;  Tian, Min;  Xiong, Ting;  Lu, Qiuhong;  Zhu, Qi;  Yang, Zhiqing;  Wang, Xiaohui;  Zhou, Yanchun
收藏  |  浏览/下载：1/0  |  提交时间：2025/04/27
MXene  Nb2CSe2  crystal structure  electronic structure  elastic properties  interlayer coupling  Raman spectroscopy  friction coefficient  
Exploring anti-ferroelectric thin films with high energy storage performance by moderating phase transition 期刊论文
APPLIED PHYSICS REVIEWS, 2024, 卷号: 11, 期号: 4, 页码: 8
作者:  Zhang, Tianfu;  Si, Yangyang;  Li, Xudong;  Li, Yijie;  Wang, Tao;  Zhang, Qinghua;  Tang, Yunlong;  Chen, Zuhuang
收藏  |  浏览/下载：2/0  |  提交时间：2025/04/27
Molecular dynamics simulations of the shear and tensile mechanical properties of rare-earth metal erbium based on deep-learning potential 期刊论文
MATERIALS TODAY COMMUNICATIONS, 2024, 卷号: 41, 页码: 11
作者:  Xue, Hong-Tao;  Chang, Zhen;  Li, Juan;  Yang, Yan-Hong;  Ren, Jun-Qiang;  Zhang, Yong;  Tang, Fu-Ling;  Lu, Xue-Feng;  Li, Jun-Chen
收藏  |  浏览/下载：1/0  |  提交时间：2025/04/27
Deep-learning potential  Molecular dynamic simulations  First-principles calculations  Rare-earth erbium  Basal/prismatic interfaces  Shear and tensile deformations  
Exploring anti-ferroelectric thin films with high energy storage performance by moderating phase transition 期刊论文
APPLIED PHYSICS REVIEWS, 2024, 卷号: 11, 期号: 4, 页码: 8
作者:  Zhang, Tianfu;  Si, Yangyang;  Li, Xudong;  Li, Yijie;  Wang, Tao;  Zhang, Qinghua;  Tang, Yunlong;  Chen, Zuhuang
收藏  |  浏览/下载：2/0  |  提交时间：2025/04/27
Substitution potential of La/Ce/Er for high-cost Sc in rare-earth Al alloys: A comprehensive first-principles study 期刊论文
PHYSICA B-CONDENSED MATTER, 2024, 卷号: 688, 页码: 9
作者:  Yang, Tao;  Yu, Wei-Yuan;  Xue, Hong-Tao;  Yang, Yan-Hong;  Tang, Fu-Ling;  Zhang, Yong;  Ren, Jun-Qiang;  Lu, Xue-Feng;  Li, Jun-Chen
收藏  |  浏览/下载：1/0  |  提交时间：2025/04/27
Rare-earth Al alloys  Substitution formation energy  gamma-Al/gamma '-Al3Sc phase interfaces  Interfacial segregation  First-principles calculation  
Regulating interfacial chemistry and kinetic behaviors of F/Mo co-doping Ni-rich layered oxide cathode for long-cycling lithium-ion batteries over-20 ° C-60 ° C 期刊论文
JOURNAL OF ENERGY CHEMISTRY, 2024, 卷号: 94, 页码: 449-457
作者:  Guan, Siqi;  Tao, Lin;  Tang, Pei;  Fang, Ruopian;  Wu, Huize;  Piao, Nan;  Yang, Huicong;  Hu, Guangjian;  Geng, Xin;  Li, Lixiang;  An, Baigang;  Li, Feng
收藏  |  浏览/下载：1/0  |  提交时间：2025/04/27
Anion -cation co-doping  Wide temperature operation  Ni-rich layered cathode  Phase transition  Surface/interface  
Deep-learning potential molecular dynamics simulations of the structural and physical properties of rare-earth metal scandium 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2024, 卷号: 242, 页码: 8
作者:  Xue, Hong-Tao;  Li, Juan;  Chang, Zhen;  Yang, Yan-Hong;  Tang, Fu-Ling;  Zhang, Yong;  Ren, Jun-Qiang;  Lu, Xue-Feng;  Li, Jun-Chen
收藏  |  浏览/下载：1/0  |  提交时间：2025/04/27
Deep potential  Molecular dynamics simulations  First-principles calculations  Rare-earth metal Sc  Phase transformation