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Vibronic intensities in the electronic spectra of transition-metal complex ions

 

作者: R. Acevedo,   G. Diaz,   J.R. Letelier,   C.D. Flint,  

 

期刊: Molecular Physics  (Taylor Available online 1990)
卷期: Volume 71, issue 5  

页码: 1063-1073

 

ISSN:0026-8976

 

年代: 1990

 

DOI:10.1080/00268979000102321

 

出版商: Taylor & Francis Group

 

数据来源: Taylor

 

摘要:

The vibronic intensities of the vibronic origins due to the three odd-parity vibrational modes of the Γ8(2T2g) → Γ8(4A2g) electronic transition of the ReBr2-6ion are calculated using both crystal-field and ligand-polarization vibronic models. The crystal-field calculations is carried out using the closure approximation, and both models employ the double-group formalism. The vibronic intensity distribution is different for the two models, but by using reasonable values of the radial integrals and atomic charges, satisfactory agreement with experiment is achieved.

 

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