Theoretical study on the spin states and intra-cluster spin relaxation of the one-dimensional metal-benzene sandwich clusters: M2(C6H6)3 (M = Sc, Ti, V)

Ayami Goto, Satoshi Yabushita

研究成果: Article査読

14 被引用数 (Scopus)

抄録

According to recent Stern-Gerlach measurements of the one-dimensional sandwich clusters, M2(C6H6)3 (M = Sc, Ti, V), the magnitudes of their magnetic moments are known to be reduced effectively from their spin-only values by a factor of 1/4 for M = Sc and Ti, and 3/5 for V. To clarify the origin of this reduction, the spin state of each cluster has been analyzed and the axial zero-field splitting parameters D have been evaluated by the second-order perturbation of spin-orbit interactions. The magnitude of D for the V2(C6H6)3 cluster is less than 10% of those for the Sc and Ti analogs, which is in accord with the experimental findings.

本文言語English
ページ(範囲)382-386
ページ数5
ジャーナルChemical Physics Letters
454
4-6
DOI
出版ステータスPublished - 2008 3月 20

ASJC Scopus subject areas

  • 物理学および天文学(全般)
  • 物理化学および理論化学

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