Huge Magnetic Anisotropy in a Trigonal-Pyramidal Nickel(II)
Complex
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Abstract
The
work presented herein shows the experimental and theoretical studies
of a mononuclear nickel(II) complex with the largest magnetic anisotropy
ever reported. The zero-field-splitting <i>D</i> parameter,
extracted from the fits of the magnetization and susceptibility measurements,
shows a large value of −200 cm<sup>–1</sup>, in agreement
with the theoretical value of −244 cm<sup>–1</sup> obtained
with the CASPT2–RASSI method
