Theoretical examination of optical and EPR spectra for Cu ion in K2PdCl4 crystal |
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| Authors: | P. Huang Hu Ping M.G. Zhao |
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| Affiliation: | Department of Information Sciences, Institute of Solid State Physics, Sichuan Normal University, Chengdu 610068, People's Republic of China |
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| Abstract: | In this work, two d-d transition spectra and four EPR parameters g∥, g⊥, A∥, A⊥ of K2PdCl4/Cu2+ are uniformly interpreted based on Zhao's crystal-field model. The calculation result is in good agreement with the experiment findings. The ligand spin-orbit coupling is neglected on the calculation, which is consistent with the ab initio result by Hillier et al. [J. Am. Chem. Soc. 98 (1976) 95] |
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| Keywords: | D. Crystal and ligand field D. Electron paramagnetic resonance |
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