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Hard versus soft: zero-field dinuclear Dy(iii) oxygen bridged SMM and theoretical predictions of the sulfur and selenium analogues.

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Two dinuclear lanthanide complexes (Gd and Dy) were prepared and characterized by X-ray, magnetic and computational methods. The Dy analogue shows SMM behavior with an energy barrier of 98.4 K… Click to show full abstract

Two dinuclear lanthanide complexes (Gd and Dy) were prepared and characterized by X-ray, magnetic and computational methods. The Dy analogue shows SMM behavior with an energy barrier of 98.4 K in the absence of an applied dc field. Theoretical calculations were performed on model complexes which support the hypothesis that the energy barrier will increase if the soft-donor atoms S and Se are used in lieu of an O donor.

Keywords: versus soft; field; soft zero; hard versus; zero field; field dinuclear

Journal Title: Dalton transactions
Year Published: 2019

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