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科研机构
金属研究所 [11]
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期刊论文 [11]
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2020 [1]
2018 [3]
2010 [3]
2009 [1]
2006 [3]
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Chemistry,... [1]
Electroche... [1]
Physics, C... [1]
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Synthesis of Ordered Pt Nanocube Arrays Directed by Block Copolymer Nanotemplate and Their Potential on Ethanol Oxidation Reaction
期刊论文
ANALYTICAL CHEMISTRY, 2020, 卷号: 92, 期号: 12, 页码: 8046-8050
作者:
Wang, Zhi-da
;
Gan, Yuan
;
Mai, Yi-lang
;
Shi, Yan
;
Cao, Shuo
收藏
  |  
浏览/下载:26/0
  |  
提交时间:2021/02/02
The surface energy and stress of metals
期刊论文
SURFACE SCIENCE, 2018, 卷号: 674, 页码: 51-68
作者:
Lee, JY
;
Punkkinen, MPJ
;
Schonecker, S
;
Nabi, Z
;
Kadas, K
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  |  
浏览/下载:20/0
  |  
提交时间:2018/12/25
Surface relaxation
Surface energy
Surface stress
Density-functional theory calculations
Metals
The surface energy and stress of metals
期刊论文
SURFACE SCIENCE, 2018, 卷号: 674, 页码: 51-68
作者:
Lee, J. -Y.
;
Punkkinen, M. P. J.
;
Schonecker, S.
;
Nabi, Z.
;
Kadas, K.
收藏
  |  
浏览/下载:18/0
  |  
提交时间:2021/02/02
Surface relaxation
Surface energy
Surface stress
Density-functional theory calculations
Metals
The Interactions between High Temperature Water and Fe3O4(111) by First-Principles Molecular Dynamics Simulation
期刊论文
INTERNATIONAL JOURNAL OF ELECTROCHEMICAL SCIENCE, 2018, 卷号: 13, 期号: 3, 页码: 2430-2440
作者:
Haitao, WT
;
Sun, XF
;
Han, EH
;
Haitao, WT (reprint author), Chinese Acad Sci, Inst Met Res, CAS Key Lab Nucl Mat & Safety Assessment, Shenyang 110016, Liaoning, Peoples R China.
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2018/06/05
316l Stainless-steel
Dissociative Adsorption
Electrochemical Noise
Corrosion Behavior
Ab-initio
304-stainless-steel
Chemistry
Surface
Resistance
Oxidation
Density function study of H-2 adsorption on LiB (010) surface
期刊论文
PHYSICA B-CONDENSED MATTER, 2010, 卷号: 405, 期号: 7, 页码: 1792-1795
作者:
Haiping, Wang
;
Xuemin, Wang
;
Fangfang, Ge
;
Mingjie, Zhou
;
Weidong, Wu
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2021/02/02
Density functional theory
LiB (010)
Adsorption energy
Electronic structure
Density function study of H-2 adsorption on LiB (010) surface
期刊论文
PHYSICA B-CONDENSED MATTER, 2010, 卷号: 405, 期号: 7, 页码: 1792-1795
作者:
Haiping, Wang
;
Xuemin, Wang
;
Fangfang, Ge
;
Mingjie, Zhou
;
Weidong, Wu
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2021/02/02
Density functional theory
LiB (010)
Adsorption energy
Electronic structure
Density function study of H(2) adsorption on LiB (010) surface
期刊论文
Physica B-Condensed Matter, 2010, 卷号: 405, 期号: 7, 页码: 1792-1795
W. Haiping
;
W. Xuemin
;
G. Fangfang
;
Z. Mingjie
;
W. Weidong
;
L. Tiecheng
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2012/04/13
Density functional theory
LiB (010)
Adsorption energy
Electronic
structure
1st-principles calculation
optical-properties
crystal-structure
atomic-hydrogen
ab-initio
dft
deuterium
tio2
ADSORPTION OF LI ON Mo(110) SURFACE: A FIRST-PRINCIPLES STUDY
期刊论文
Surface Review and Letters, 2009, 卷号: 16, 期号: 4, 页码: 589-597
Y. G. Zhou
;
X. T. Zu
;
J. L. Nie
;
H. Y. Xiao
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2012/04/13
Density functional theory
Mo
Li
work function
structural-properties
hydrogen adsorption
alkali-metals
work
function
anomalies
cesium
mo
sb
pseudopotentials
spectroscopy
First-principles study on the geometry and stability of CO and hydrogen coadsorption on the Ni(111)2x2 surface
期刊论文
Chemical Physics, 2006, 卷号: 323, 期号: 2-3, 页码: 334-340
L. Xu
;
H. Y. Xiao
;
X. T. Zu
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2012/04/14
first-principles study
CO
hydrogen
coadsorption
Ni(111)
density-functional theory
reflection-absorption spectroscopy
x-ray-diffraction
carbon-monoxide
chemisorbed co
ni(111)-c(4x2)-2co
structure
atmospheric-pressure
vibrational-spectra
adsorption sites
ni(110)
First-principles study of H adsorption on and absorption in Cu(111) surface
期刊论文
Chemical Physics, 2006, 卷号: 321, 期号: 1-2, 页码: 48-54
J. L. Nie
;
H. Y. Xiao
;
X. T. Zu
收藏
  |  
浏览/下载:21/0
  |  
提交时间:2012/04/14
density functional theory calculations
copper
hydrogen
subsurface
energy-loss spectroscopy
subsurface occupation
atomic-hydrogen
chemisorption
pseudopotentials
vibration
dynamics
pt(111)
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