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  • 收录类型=SCI-EXPANDEDx
  • 人物=王金龙x

15 条 记 录,以下是 1-15

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Interaction of Pd single atoms with different CeO2 crystal planes: A first-principles study被引量:13收藏 分享
作者:He, Bingling Wang, Jinlong Ma, Dongwei Tian, Zhixue Jiang, Lijuan Xu, Yan Cheng, Sujun
机构:Xinxiang Univ;Anyang Normal Univ;Hebei Normal Univ
来源:APPLIED SURFACE SCIENCE  2018
关键词:Crystal-plane dependence   Pd single atoms   CeO2 surfaces   First-principles calculations  
Molecular dynamics study on the origin of fuzz structure on tungsten surface被引量:10收藏 分享
作者:Wang, Jinlong Liu, Daping Guo, Zhichao He, Bingling Dang, Wenqiang
机构:Xinxiang Univ;Tianshui Normal Univ
来源:JOURNAL OF NUCLEAR MATERIALS  2021
关键词:Helium cluster   Tungsten   Fuzz   Molecular dynamics simulation  
Study of water adsorption on graphene edges被引量:10收藏 分享
作者:Jiang, Lijuan Wang, Jinlong Liu, Peng Song, Wei He, Bingling
机构:Xinxiang Univ;Tsinghua Univ
来源:RSC ADVANCES  2018
关键词:Adsorption - Work function  
H2O adsorption on the Au and Pd single atom catalysts supported on ceria: A first-principles study被引量:7收藏 分享
作者:He, Bingling Shen, Jiansheng Ma, Dongwei Wang, Jinlong Cheng, Sujun Tian, Zhixue
机构:Xinxiang Univ;Anyang Normal Univ;Hebei Normal Univ
来源:APPLIED SURFACE SCIENCE  2018
关键词:First-principles calculations   Single-atom catalyst   CeO2   H2O adsorption   Dissociation  
First-principles study on the structures and electronic properties of graphene-supported Ni-n (n=1-6) clusters被引量:6收藏 分享
作者:Song, Wei Wang, Jin-long Wang, Bin Hu, Wei-ping Wang, Ying
机构:Xinxiang Univ;Henan Univ;Chinese Acad Sci
来源:MOLECULAR SIMULATION  2018
关键词:First-principle   graphene   magnetic properties   charge transfer  
Size effect of He clusters on the interactions with self-interstitial tungsten atoms at different temperatures*被引量:4收藏 分享
作者:Wang, Jinlong Dang, Wenqiang Liu, Daping Guo, Zhichao
机构:Xinxiang Univ;Tianshui Normal Univ
来源:CHINESE PHYSICS B  2020
关键词:helium cluster   self-interstitial   tungsten   molecular dynamics simulation  
Structural, electronic and magnetic properties of NM-doped Ni clusters (NM=Cu, Ag, Au)被引量:4收藏 分享
作者:Song, Wei Fu, Zhe Wang, Jin-long Zhang, Wei
机构:Henan Inst Technol;Xinxiang Univ;Jilin Univ
来源:JOURNAL OF MOLECULAR STRUCTURE  2019
关键词:First-principle   Magnetic property   Charge transfer   Relative stability  
First-principles studies on the doping effect of Nin-1TM (n=13, 19, 55)被引量:2收藏 分享
作者:Song, Wei Kuang, Tao Fu, Zhe Wang, Jin-long Zhang, Wei Ma, Peng-fei
机构:Henan Inst Technol;Xinxiang Univ;Xinxiang Univ;Jilin Univ
来源:COMPUTATIONAL AND THEORETICAL CHEMISTRY  2019
关键词:Density functional theory   Magnetic property   Charge transfer   Dope   Density of states  
First-Principles Study of the Structures and Electronic Properties for NinGe (n=19-29) Clusters被引量:2收藏 分享
作者:Song, Wei Fu, Zhe Liu, Tian-hui Wang, Jin-long Wang, Bin Zhang, Wei Yuan, Yuan
机构:Xinxiang Univ;Jilin Univ;Changchun Univ Technol;Elect Informat Prod Supervis Inspect Inst Jilin P
来源:JOURNAL OF CLUSTER SCIENCE  2019
关键词:First-principle   Magnetic property   Charge transfer   Ionization potential   Electron affinity  
First-principles insight of hydrogen dissolution and diffusion properties in ?-Al2O3被引量:2收藏 分享
作者:Pan, Xin-Dong Li, Xiao-Chun Wang, Jinlong Xu, Bai-Chuan Lyu, Yi-Ming Xu, Yu-Ping Zhao, Xueli Zhou, Hai -Shan Luo, Guang-Nan
机构:Chinese Acad Sci;Univ Sci & Technol China;Xinxiang Univ
来源:JOURNAL OF NUCLEAR MATERIALS  2023
关键词:&gamma   -Al (2) O (3)   First-principles theory   Vibration   Hydrogen   Permeation  
Molecular dynamics study on melting point of tungsten nanostructures被引量:1收藏 分享
作者:Wang, Jinlong Chai, Jun Dang, Wenqiang Pan, Xin-Dong Li, Xiao-Chun Luo, Guang-Nan
机构:Xinxiang Univ;Chinese Acad Sci;Tsinghua Univ;Tianshui Normal Univ
来源:NUCLEAR MATERIALS AND ENERGY  2022
关键词:Nano-structure   Tungsten   Melting point   Molecular dynamics  
First-principles study of He trapping in eta-Fe2C被引量:1收藏 分享
作者:He, Bing-Ling Wang, Jin-Long Tian, Zhi-Xue Jiang, Li-Juan Song, Wei Bin Wang
机构:Xinxiang Univ;Hebei Normal Univ
来源:CHINESE PHYSICS B  2016
关键词:He bubble   eta-Fe2C   ferritic steels   first-principles  
Structures and Electronic Properties of Ni-Al Alloy Clusters from First-Principles Calculations被引量:1收藏 分享
作者:Song, Wei Wang, Bin Wang, Jin-long Fu, Ling Pu, Chun-ying Xu, Xiu-mei Zhu, Yong-sheng He, Chao-zheng Li, Gen-quan
机构:Xinxiang Univ;Nanyang Normal Univ;Nanyang Normal Univ
来源:JOURNAL OF CLUSTER SCIENCE  2017
关键词:Ni-Al alloy clusters   First-principle   Magnetic properties   Charge transfer   Density of states  
Atomic study of the trapped and migration patterns of point defects around screw dislocation in tungsten被引量:1收藏 分享
作者:Xu, Bai-Chuan Li, Xiao-Chun Wang, Jinlong Zhao, Xueli Li, Ya-Wen Pan, Xin-Dong Zhou, Hai-Shan Luo, Guang-Nan
机构:Chinese Acad Sci;Univ Sci & Technol China;Xinxiang Univ
来源:NUCLEAR MATERIALS AND ENERGY  2023
关键词:Screw dislocation   Vacancy   Self -interstitial atom   Binding energy   Diffusion mechanism  
First-Principles Study of the Structures and Electronic Properties of Ni Aln-1 (n=2-20) Clusters被引量:0收藏 分享
作者:Song, W. Wang, B. Li, H-Q. Wang, J-L. He, C-Z.
机构:Xinxiang Univ;Nanyang Normal Univ;Xinxiang Univ
来源:JOURNAL OF STRUCTURAL CHEMISTRY  2018
关键词:magnetic property   charge transfer   ionization potential   electron affinity  
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