On the use of two-dimensional potential surface cross sections in the discussion of vibronic spectra of transition metal complexes
✍ Scribed by Patrick E. Hoggard; Hans-Herbert Schmidtke
- Publisher
- Elsevier Science
- Year
- 1974
- Tongue
- English
- Weight
- 406 KB
- Volume
- 25
- Category
- Article
- ISSN
- 0009-2614
No coin nor oath required. For personal study only.
✦ Synopsis
For purposes of intcrprering broad band electronic spectra of compleses, the 3h'-5 dimensianai potential energy hypersurfzxe may be reduced substanttil~.
Consideration of the geometry of the orbital transition involved allows selection of an appropriate cross section, depending on which features should be represented. In addition, the orbital transition geometry predicts which vibmtionti modes will'contribute significantly to the width of the spectrum. In the particular c;Ise of the first and second spin-allowed brands in d3 and d6 complexes, atg and eg modes are responsible for the band width.