Lin-Hua Xie
Physics Department, Sichuan Normal University, No. 5 Jing'An Road, Sichuan, Chengdu 610066, China.
Spectrochim Acta A Mol Biomol Spectrosc. 2008 Dec 1;71(3):993-5. doi: 10.1016/j.saa.2008.02.026. Epub 2008 Mar 10.
In this work, a full ligand-field energy matrix (45 x 45) diagonalization treatment for 3d(2) ions in trigonal symmetry C(3v) is performed on the basis of a central metal ion-ligand covalency model including the ligand spin-orbit (SO) coupling. Optical fine structure and electron paramagnetic resonance (EPR) spectra of ZnO:V(3+) are uniformly explained.
在这项工作中，基于包含配体自旋轨道（SO）耦合的中心金属离子-配体共价模型，对三角对称C(3v)中的3d(2)离子进行了完整的配体场能量矩阵（45×45）对角化处理。统一解释了ZnO:V(3+)的光学精细结构和电子顺磁共振（EPR）光谱。
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