Electronic structure and magnetic properties of clusters with (μ-1,1-N3) bridges

被引:0
|
作者
Rakitin, YV [1 ]
Khodasevich, SG [1 ]
Starodub, OR [1 ]
Kalinnikov, VT [1 ]
机构
[1] Russian Acad Sci, Kola Res Ctr, Inst Rare Element & Mineral Chem & Technol, Apatity 184200, Murmansk Oblast, Russia
基金
俄罗斯基础研究基金会;
关键词
D O I
10.1023/A:1009592621701
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
Quantum-chemical calculations and a generalized angular overlap model were used to demonstrate that the electronic structure of N-3(-) anions is favorable for the development of ferromagnetic properties in poly-nuclear complexes whose structural elements are planar binuclear fragments of the M(N-3)(2)M type characterized by a broad range of M-N-M angles (95 degrees -105 degrees). Analysis of the known experimental data points to the correctness of the theoretical views and demonstrates the ferromagnetic stability of complexes of this type to the deviation of the N-3 ligands from the plane of the MN2M ring.
引用
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页码:1 / 4
页数:4
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