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arxiv: 1211.6288 · v4 · pith:3DRAHPZXnew · submitted 2012-11-27 · ❄️ cond-mat.mtrl-sci

Exchange Interactions in a Dinuclear Manganese (II) Complex with Cyanopyridine-N-oxide Bridging Ligands

classification ❄️ cond-mat.mtrl-sci
keywords exchangecomplexcyanopyridine-n-oxidedinuclearmagneticmanganeseapproximationbehavior
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The structure and magnetic properties of oligonuclear manganese complex [Mn(hfa)2cpo]2 (where hfa is hexafluoroacetylacetonate dehydrate and cpo is 4-cyanopyridine-N-oxide) are presented. In the unit cell, the dinuclear molecules are well isolated from each other. The non-monotonous dependence of magnetic susceptibility is explained in terms of the hierarchy of exchange parameters by using exact diagonalization. The thermodynamic behavior of pure cpo and [Mn(hfa)2(cpo)]2 is simulated numerically in a dimer approximation by an extrapolation to spin S = 5/2. The Mn-Mn exchange integral is evaluated.

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