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 [14]
采集方式
OAI收割 [14]
内容类型
期刊论文 [14]
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2008 [3]
2007 [3]
2006 [2]
2005 [2]
2004 [2]
2003 [1]
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First principles study on the electronic structure of the two chain compounds of M(N-3)(2) (HCOO) (CH3)(2)NH2 (M = Fe and Co)
期刊论文
OAI收割
Solid State Communications, 2008, 卷号: 145, 期号: 1-2, 页码: 43-47
J. Zhang
;
K. L. Yao
;
Z. L. Liu
;
G. Y. Gao
;
X. C. Wang
;
Y. L. Li
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2012/04/13
organic magnet
magnetic semiconductors
first principles
electronic
structure
coupled organic ferromagnets
crystal-structure
magnetic-properties
complexes
azido
model
Ab initio studies on the stability, magnetic property and electronic structure of the molecule-based magnet: Mn-2(dpp)(2)(H2O)(2)Cl-4 center dot 2H(2)O, dpp=2,3-bis(2-paridyl) pyrazine
期刊论文
OAI收割
Solid State Communications, 2008, 卷号: 145, 期号: 7-8, 页码: 364-367
S. W. Fan
;
K. L. Yao
;
Z. L. Liu
;
Z. W. Wang
收藏
  |  
浏览/下载:34/0
  |  
提交时间:2012/04/13
organic magnetic semiconductors
ab initio method
electronic structure
ferromagnetic properties
copper(ii) binuclear compounds
transition-metal-complexes
density-functional theory
iron-sulfur clusters
organic ferromagnets
theoretical-model
systems
Specific Heat and Charge Density of Quasi-One-Dimensional Interchain Coupling Organic Ferromagnets
期刊论文
OAI收割
Communications in Theoretical Physics, 2008, 卷号: 50, 期号: 6, 页码: 1435-1438
Z. L. Wang
;
K. L. Yao
收藏
  |  
浏览/下载:23/0
  |  
提交时间:2012/04/13
specific heat
charge density
organic ferromagnets
polymer ferromagnets
free-radicals
state
model
The electronic structure and the ferromagnetic intermolecular interactions in the crystal of a diphenyl nitroxide derivative
期刊论文
OAI收割
Philosophical Magazine, 2007, 卷号: 87, 期号: 27, 页码: 4119-4129
L. Zhu
;
K. L. Yao
;
Z. L. Liu
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2012/04/13
organic ferromagnets
free-radicals
transition
magnets
model
First principles study on the electronic structure of the organic conductors (EDT-TSF)(2)MCl4 (M-Ga and Fe)
期刊论文
OAI收割
Physica B-Condensed Matter, 2007, 卷号: 398, 期号: 1, 页码: 40-45
K. L. Yao
;
J. Zhang
;
Z. L. Liu
;
G. Y. Gao
;
X. C. Wang
;
Y. L. Li
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2012/04/13
first principles
electronic structure
organic magnet
FP-LAPW method
ferromagnets
First-principle study on the electronic structure and ferromagnetic properties of a three-dimensional coordination polymer: Cu(HCO2)(2)L (L=4,4 '-bipyridine)
期刊论文
OAI收割
Physica B-Condensed Matter, 2007, 卷号: 395, 期号: 1-2, 页码: 84-87
K. L. Yao
;
S. W. Fan
;
Z. L. Liu
;
Y. L. Li
收藏
  |  
浏览/下载:23/0
  |  
提交时间:2012/04/13
density-function theory
electronic structure
ferromagnetic properties
organic ferromagnets
magnetic-properties
molecular magnets
temperature
surfaces
chains
model
The electronic structure and the ferromagnetic intermolecular interactions in the crystal of TEMPO radicals
期刊论文
OAI收割
Journal of Magnetism and Magnetic Materials, 2006, 卷号: 301, 期号: 2, 页码: 301-307
L. Zhu
;
K. L. Yao
;
Z. L. Liu
收藏
  |  
浏览/下载:28/0
  |  
提交时间:2012/04/14
DFT
4-benzylideneamino-2
the organic magnet
2
electronic structure
6
ferromagnetic properties
6-tetramethylpiperidin-1-oxyl
coupled organic ferromagnets
1st-principles
model
First-principle calculation on the electronic structure of the molecule-based ferromagnet Co P(CN)(2) (2) and M N(CN)(2) (2) (M = Co, Ni)
期刊论文
OAI收割
Chemical Physics Letters, 2006, 卷号: 424, 期号: 1-3, 页码: 209-213
L. Zhu
;
K. L. Yao
;
Z. L. Liu
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2012/04/14
organic ferromagnets
magnetic-materials
dicyanamide anion
First principle calculation on the electronic structure of the copper (II)-azido compound {Cu(L)(N-3)(2)}(n) (L = benzylamine)
期刊论文
OAI收割
Journal of Magnetism and Magnetic Materials, 2005, 卷号: 288, 页码: 331-338
Y. S. Zhang
;
Y. L. Yao
;
Z. L. Liu
收藏
  |  
浏览/下载:31/0
  |  
提交时间:2012/04/14
[{Cu(L)(N-3)(2)}(n)]
ferromagnetic
azido group
end-to-end
organic ferromagnets
magnetic-properties
crystal-structure
on azido
antiferromagnetic interactions
magnetostructural correlations
nickel(ii) complexes
dinuclear complex
molecular magnets
Ab initio study of electronic structure and magnetic properties of copper (II) terephthalate
期刊论文
OAI收割
Physica B-Condensed Matter, 2005, 卷号: 370, 期号: 1-4, 页码: 104-109
L. Zhu
;
K. L. Yao
;
Z. L. Liu
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2012/04/14
ab initio
FP-LAPW
electronic structure
ferromagnetic properties
organic ferromagnets
polymer