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科研机构
金属研究所 [6]
内容类型
期刊论文 [6]
发表日期
2007 [1]
2006 [1]
2005 [4]
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First-principles studies on the conductive and ferromagnetic properties of Mn(ins)( mu(1,1)-N-3(CH3OH) (2)
期刊论文
Physica B-Condensed Matter, 2007, 卷号: 392, 期号: 1-2, 页码: 318-322
K. L. Yao
;
N. Liu
;
Z. L. Liu
;
Y. L. Li
;
G. Y. Gao
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浏览/下载:12/0
  |  
提交时间:2012/04/13
first principles
azido group
ferromagnetic
electronic structure
copper (ii)-azido compound
end-on azido
magnetic-properties
magnetostructural correlations
structural-characterization
nickel(ii)
complexes
electronic-structure
crystal-structures
bridging ligand
systems
The magnetic behavior and electronic structure of manganese (II)-azido complex Mn(L)(2)(N3)(2) (n) studied by first-principle calculation
期刊论文
Physics Letters A, 2006, 卷号: 359, 期号: 3, 页码: 227-233
K. L. Yao
;
Y. S. Zhang
;
Z. L. Liu
;
L. H. Yu
;
X. L. Wang
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  |  
浏览/下载:21/0
  |  
提交时间:2012/04/14
[Mn(L)(2)(N3)(n)]
azido group
end-on azido
copper(ii) dinuclear complex
crystal-structure
antiferromagnetic interactions
magnetostructural correlations
ferromagnetic interaction
nickel(ii) complexes
compound
ligand
perchlorate
Two ferromagnetic azido-bridged copper(II) complexes studied by first-principle electronic-structure calculation
期刊论文
Journal of Chemical Physics, 2005, 卷号: 123, 期号: 12
Y. S. Zhang
;
K. L. Yao
;
Z. L. Liu
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  |  
浏览/下载:15/0
  |  
提交时间:2012/04/14
end-on azido
crystal-structure
antiferromagnetic interactions
magnetostructural correlations
nickel(ii) complexes
magnetic-properties
dinuclear complex
compound
ligand
perchlorate
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
Journal of Magnetism and Magnetic Materials, 2005, 卷号: 288, 页码: 331-338
Y. S. Zhang
;
Y. L. Yao
;
Z. L. Liu
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  |  
浏览/下载:14/0
  |  
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
The ferromagnetic copper (II)-azido compound Cu(L)(2)(N-3)(2) (n) L=4-(dimethylamino)pyridine studied by first-principle calculation
期刊论文
Physica B-Condensed Matter, 2005, 卷号: 358, 期号: 1-4, 页码: 216-223
Y. S. Zhang
;
K. L. Yao
;
Z. L. Liu
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  |  
浏览/下载:21/0
  |  
提交时间:2012/04/14
[Cu(L)(2)(N-3)(2)](n)
azido group
spin delocalization
end-to-end
magnetostructural correlations
magnetic-properties
molecular magnets
crystal-structure
on azido
antiferromagnetic
interactions
nickel(ii) complexes
dinuclear complex
bridges
Strong ferromagnetic coupling of { Cu(Hpht)(N-3) center dot H2O}(n) with simultaneous end-on azido and carboxylato bridges: A first principle study
期刊论文
Communications in Theoretical Physics, 2005, 卷号: 43, 期号: 2, 页码: 349-352
K. L. Yao
;
F. X. Zu
;
Z. L. Liu
;
W. D. Zou
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  |  
浏览/下载:14/0
  |  
提交时间:2012/04/14
ferromagnetic coupling
spin polarization
superexchange interaction
crystal-structure
magnetostructural correlations
complexes
systems
compound
behavior
chain
state
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