Chem. J. Chinese Universities ›› 1991, Vol. 12 ›› Issue (3): 361.

• Articles • Previous Articles     Next Articles

Theoretical Studies on Spin Hamiltonian of Transition Metal Complexes

Ba Xin-wu, Li Bo-fu, Sun Jia-zhong   

  1. Institute of Theoretical Chemistry, JiLin University, Changchun, 130023
  • Received:1989-05-03 Online:1991-03-24 Published:1991-03-24

Abstract: By means of the irreducible tensor method, a theoretical approach to the spin Hamiltonian of transition metal complexes involving the spin-orbit interaction, spin-other orbit interaction, Fermi interaction, magnetic spin-spin interaction and external magentic interaction is proposed. The parameter of the spin Hamiltonian, expressed in the molecular parameters is obtained. Under approximation of atomic orbital, the g-factor of ruby is calculated and the result is in good agreement with the experiments.

Key words: Spin Hamiltonian, Magnetic spin-spin interaction, Fermi interaction, Lande-factor, Quasi-spin

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