中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
金属研究所 [2]
福建物质结构研究所 [1]
采集方式
OAI收割 [3]
内容类型
期刊论文 [3]
发表日期
2011 [1]
2010 [1]
2009 [1]
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Structural and electronic properties of silver-doped gold clusters Au(n)Ag(v) (2 <= n <= 10; v=0,+/- 1): comparison with pure gold clusters
期刊论文
OAI收割
Molecular Physics, 2011, 卷号: 109, 期号: 16, 页码: 2057-2068
P. Lu
;
X. Y. Kuang
;
A. J. Mao
;
Z. H. Wang
;
Y. R. Zhao
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2012/04/13
silver-doped gold cluster
geometric structure
electronic property
density functional theory
relative stability
density-functional calculations
ion mobility measurements
effective
core potentials
molecular calculations
photoelectron-spectroscopy
nanostructures
transition
oxidation
anions
shape
Geometries, stabilities, and magnetic properties of Cr@Au(n) (n = 1-8) clusters: Density functional theory study
期刊论文
OAI收割
Physica a-Statistical Mechanics and Its Applications, 2010, 卷号: 389, 期号: 22, 页码: 5216-5222
D. Die
;
X. Y. Kuang
;
J. J. Guo
;
B. X. Zheng
收藏
  |  
浏览/下载:22/0
  |  
提交时间:2012/04/13
Au(n)Cr clusters
Geometrical structure
Relative stability
Magnetic
property
effective core potentials
molecular calculations
approximation
gold
Structures and Vibrational Frequencies of Gas Phase and Solvated Uranyl Complexes UO2Ln2-n*a(L=F-, CO32-, NO3-; n=0-6, a=1, 2)
期刊论文
OAI收割
Acta Physico-Chimica Sinica, 2009, 卷号: 25, 期号: 4, 页码: 655-660
J. F. Gu, C. H. Lu, W. K. Chen, Y. Xu and J. D. Meng
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  |  
浏览/下载:33/0
  |  
提交时间:2012/11/06
Uranyl cation
Density functional theory
Relative effective core
potential
Solution effect
Vibration frequency
ligand-exchange reactions
effective core potentials
ab-initio
crystal-structure
aqueous-solution
carbonate
coordination
chemistry
mechanism
dynamics