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科研机构
山东大学 [27]
内容类型
期刊论文 [27]
发表日期
2018 [27]
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共27条,第1-10条
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专题:山东大学
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发表日期:2018
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Adsorption mechanisms of metal ions on the potassium dihydrogen phosphate (100) surface: A density functional theory-based investigation
期刊论文
JOURNAL OF COLLOID AND INTERFACE SCIENCE, 2018, 卷号: 522, 页码: 256-263
作者:
Wu, Yulin
;
Zhang, Lei
;
Liu, Yao
;
Qu, Yunpeng
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/12/11
Density functional theory
Potassium dihydrogen phosphate
KDP
Metal
ion
Adsorption mechanism
Adsorption mechanisms of metal ions on the potassium dihydrogen phosphate (1 0 0) surface: A density functional theory-based investigation
期刊论文
Journal of Colloid and Interface Science, 2018, 卷号: 522, 页码: 256-263
作者:
Wu, Yulin
;
Zhang, Lei
;
Liu, Yao
;
Qu, Yunpeng
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2019/12/11
Theoretical investigations on the d-p hybridized aromaticity, photoelectron spectroscopy and neutral salts of the LaX(2)over-bar(X=Al, Ga, In) clusters
期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2018, 卷号: 203, 页码: 132-138
作者:
Chen, Jing
;
Yang, Huan
;
Wang, Jing
;
Cheng, Shi-Bo
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2019/12/11
Simulated photoelectron spectrum
Lanthanum-doped clusters
d-p
hybridized aromaticity
Density functional theory
Molecular orbitals
Theoretical investigations on the d-p hybridized aromaticity, photoelectron spectroscopy and neutral salts of the LaX2 − (X=Al, Ga, In) clusters
期刊论文
Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy, 2018, 卷号: 203, 页码: 132-138
作者:
Chen J.
;
Yang H.
;
Wang J.
;
Cheng S.-B.
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/12/11
d-p hybridized aromaticity
Density functional theory
Lanthanum-doped clusters
Molecular orbitals
Simulated photoelectron spectrum
Adsorption mechanisms of metal ions on the potassium dihydrogen phosphate (1 0 0) surface: A density functional theory-based investigation
期刊论文
Journal of Colloid and Interface Science, 2018, 卷号: 522, 页码: 256-263
作者:
Wu Y.
;
Zhang L.
;
Liu Y.
;
Qu Y.
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2019/12/11
Adsorption mechanism
Density functional theory
KDP
Metal ion
Potassium dihydrogen phosphate
Corrosion Protection Properties of Nano NH2-Reduced Graphene Oxide/Epoxy Composite Coatings Formed by Self-Curing on Magnesium Alloy
期刊论文
JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY, 2018, 卷号: 18, 期号: 7, 页码: 4971-4981
作者:
Jin, Tao
;
Han, Yongqin
;
Bai, Ruiqin
;
Liu, Xin
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/11
NH2-Reduced Graphene Oxide
Corrosion Protection Mechanism
Magnesium
Alloy
Density Functional Theory
Calcium intercalation underneath N-layer graphene on 6H-SiC(0001)
期刊论文
CHEMICAL PHYSICS LETTERS, 2018, 卷号: 703, 页码: 33-38
作者:
Zhang, Yuxi
;
Zhang, Hanjie
;
Cai, Yiliang
;
Song, Junjie
;
Qiao, Dan
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2019/12/11
Epitaxial Graphene
Metal intercalation
Scanning tunneling microscopy
Density functional theory
An insight into the effects of transition metals on the thermal expansion of complex perovskite compounds: an experimental and density functional theory investigation
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 26, 页码: 17781-17789
作者:
Wang, Xiao
;
Han, Ye
;
Song, Xiaojie
;
Liu, Weihui
;
Jin, Yinxi
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2019/12/11
A DFT Study on CuH-Catalyzed Reductive Relay Hydroamination for Synthesis of Remote-Chiral Amine
期刊论文
CHEMISTRYSELECT, 2018, 卷号: 3, 期号: 7, 页码: 2157-2161
作者:
Gao, Yun
;
Wang, Ping
;
Zhao, Yang
;
Liu, Qingyun
;
Liu, Wei
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/12/11
Density functional theory
Enantioselectivity
Hydroamination
Mechanism
Adsorption of O2 on the M doped (M=Fe, Co, Al, Cu, and Zn) SiC sheets: DFT study
期刊论文
Computational Condensed Matter, 2018, 卷号: 16
作者:
Sun L.
;
Hu J.
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2019/12/11
Adsorption
Density functional theory
M doping
SiC sheet
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