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The electronically excited and ionic states of sulphur dioxide: an ab initio molecular orbital CI study and comparison with spectral data

✍ Scribed by Palmer *, Michael H.; Shaw, David A.; Guest, Martyn F.


Book ID
121422335
Publisher
Taylor and Francis Group
Year
2005
Tongue
English
Weight
484 KB
Volume
103
Category
Article
ISSN
0026-8976

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Ab initio molecular orbital and density
✍ A. M. Mebel; H. L. Lin; S. H. Lin πŸ“‚ Article πŸ“… 1999 πŸ› John Wiley and Sons 🌐 English βš– 236 KB πŸ‘ 2 views

The structure and energetics of the C H и I complex have been studied 6 6 2 1 1.55 eV difference between the vertical and adiabatic excitation energies of 4 AЈ and the dramatic geometry change in the CT state.