Theoretical Explanations of the Optical Band Positions and Local Structure for Cu2+ Centers in ZnO-Bi2O3-B2O3-CuO Glasses |
| M. Yuan
Physical Experiment Center, School of Optoelectronic Information, Chongqing University of Technology, Chongqing 400054, China |
| Received: May 23, 2014; In final form: December 5, 2014 |
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| The local structure, two optical band positions and three electronic spin resonance parameters for Cu2+ centers at the tetragonally-distorted octahedral sites in ZnO-Bi2O3-B2O3-CuO glasses are calculated from the high-order perturbation method based on the two-spin-orbit-parameter model, where the contributions from both the spin-orbit coupling parameters of central dn ion and ligand ion are included. The theoretical results are in good agreement with the experimental values. The calculations show that the high-order perturbation method based on the two-spin-orbit-parameter model is effective in the explanations of optical spectra, electronic spin resonance parameters and local distortion structure for d9 ions in glasses. |
DOI: 10.12693/APhysPolA.126.1293 PACS numbers: 61.72.Bb, 75.10.Dg, 76.30.-v, 76.30.Fc |