Magnetic anisotropy in the excited states of low symmetry lanthanide complexes

Literature Information

Publication Date 2011-10-25
DOI 10.1039/C1CP22689D
Impact Factor 3.676
Authors

Liviu Ungur, Liviu F. Chibotaru


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Abstract

Ab initio investigation of multiplet spectrum of lanthanides in archetypal coordination geometries shows an unexpected regular structure consisting of (i) mirror symmetry of anisotropic magnetic properties of doublet states, (ii) high magnetic axiality of low-lying and high-lying doublets, comparable to complexes with ideal axial symmetry, and (iii) the strong rotation of the anisotropy axes of individual doublets. The obtained high axiality of the ground doublet states explains the SMM behaviour of low-symmetry lanthanide complexes.

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Physical Chemistry Chemical Physics
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