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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：3/0  |  提交时间：2025/04/27
Highly efficient layered Ir sub-nanoclusters for antibacterial application 期刊论文
NANO RESEARCH, 2025, 卷号: 18, 期号: 3, 页码: 8
作者:  Yang, Lini;  Zhu, Pengbo;  Li, Tao;  Jiao, Yueyue;  Cai, Xiangbin;  Liang, Jialan;  Zhang, Hexin;  Wang, Ning;  Chen, Xiaowen;  Liu, Hongyang
收藏  |  浏览/下载：2/0  |  提交时间：2025/04/27
defect-rich graphene  Ir catalyst  sub-nanocluster  peroxidase-like activity  antibacterial application  
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  
Sulfonated sucrose-derived carbon: efficient carbocatalysts for ester hydrolysis 期刊论文
NEW JOURNAL OF CHEMISTRY, 2024, 卷号: 48, 期号: 44, 页码: 18796-18802
作者:  Wen, Guodong;  Na, Duo;  Yan, Yukun;  Liu, Hongyang
收藏  |  浏览/下载：1/0  |  提交时间：2025/04/27
Fully Exposed Ru Clusters for the Efficient Multi-Step Toluene Hydrogenation Reaction 期刊论文
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2024, 页码: 8
作者:  Wang, Yue;  Yu, Hancheng;  He, Yurong;  Xiang, Shengling;  Qin, Xuetao;  Yang, Lini;  Chen, Jiawei;  Si, Yang;  Zhang, Jingwang;  Diao, Jiangyong;  Wang, Ning;  Peng, Mi;  Ma, Ding;  Liu, Hongyang
收藏  |  浏览/下载：3/0  |  提交时间：2025/04/27
Ruthenium  clusters  heterogeneous catalysis  toluene  hydrogenation  
The toughening effect of twins on fracture in nanotwinned Cu during cyclic loading 期刊论文
ACTA MATERIALIA, 2024, 卷号: 278, 页码: 15
作者:  He, S. Y.;  Jiang, B. B.;  Lu, N.;  Chen, C. J.;  Cui, J. P.;  Huang, Z. Y.;  Jin, S.;  Ye, H. Q.;  Lu, L.;  Du, K.
收藏  |  浏览/下载：3/0  |  提交时间：2025/04/27
Transmission electron microscopy  Microstructure  Nanotwins  Toughness  Fatigue crack  
Fully Exposed Nickel Clusters for Semihydrogenation of Acetylene 期刊论文
ACS CATALYSIS, 2024, 卷号: 14, 期号: 19, 页码: 14689-14695
作者:  Sui, Chengquan;  Ma, Huan;  Huang, Fei;  Wang, Maolin;  Cai, Xiangbin;  Diao, Jiangyong;  Ren, Pengju;  Wen, Xiaodong;  Jin, Li;  Wang, Guoqing;  Ma, Ding;  Liu, Hongyang
收藏  |  浏览/下载：1/0  |  提交时间：2025/04/27
semihydrogenation reaction  non-noble metalcatalyst  atomically dispersed metal catalyst  fullyexposed cluster  acetylene  
Fully Exposed Nickel Clusters for Semihydrogenation of Acetylene 期刊论文
ACS CATALYSIS, 2024, 卷号: 14, 期号: 19, 页码: 14689-14695
作者:  Sui, Chengquan;  Ma, Huan;  Huang, Fei;  Wang, Maolin;  Cai, Xiangbin;  Diao, Jiangyong;  Ren, Pengju;  Wen, Xiaodong;  Jin, Li;  Wang, Guoqing;  Ma, Ding;  Liu, Hongyang
收藏  |  浏览/下载：2/0  |  提交时间：2025/04/27
semihydrogenation reaction  non-noble metalcatalyst  atomically dispersed metal catalyst  fullyexposed cluster  acetylene  
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：2/0  |  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  
A Novel Insight Toward Zr Poisoning on Grain Refinement of Al-5Ti-1B and Its Solution 期刊论文
METALLURGICAL AND MATERIALS TRANSACTIONS B-PROCESS METALLURGY AND MATERIALS PROCESSING SCIENCE, 2024, 页码: 11
作者:  Zhang, Lili;  Yang, Linjie;  Zhao, Jiuzhou;  Shen, Zheling;  Li, Qian;  Jiang, Hongxiang;  He, Jie
收藏  |  浏览/下载：1/0  |  提交时间：2025/04/27