Theoretical studies of spin-Hamiltonian
โ
Fang Wang; Wu Xiao-Xuan; Zheng Wen-Chen
๐
Article
๐
2008
๐
Elsevier Science
๐
English
โ 136 KB
In this paper, the high-order perturbation formulas of spin-Hamiltonian (SH) parameters (g factors g J , g ? and zero-field splitting D), including both the crystal-field (CF) and for the first time charge-transfer (CT) mechanisms, are established for 3d 8 ions in trigonal octahedral clusters. By us