组态d^N在D_(3h)对称场中稳定化能的推求方法

A calculation method of LFSE for d^N-D_(3h) system

介绍一种推求组态 d N在 D3h对称场中稳定化能的方法 ,它是根据配体场势的可合性和可分性以及立体构型的可合性和可分性两条原则 ,利用简单的代数运算方法 ,由常见对称场中各 d轨道的相对能量算得 D3h对称性的 ML3和 ML5构型配合物中各 d轨道相对能量 ,尔后求出组态 d N在 D3h对称场中的稳定化能。

A calculation method of LFSE for d N-D 3h system has been reported in this paper.A according to the principle of syncretism and partition of V CF and that of tridimensional configuration ,we have calculated the relative energy of d orbital in ML 3 and ML 5 symmetry field by simple algebraic operation with the relative energy of d orbital in common symmetry field .LFSE for d N-D 3h system has been calculated furthermore.