Forbidden transitions in benzene
We have computed the optical oscillator strengths for the symmetry-forbidden transitions 11B2u<--X and 11B1u<--X of benzene through vibronic coupling. Electronic transition dipole moments were calculated at the complete active space self consistent field level along the normal coordinates. Opt...
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| Outros Autores: | , , |
| Formato: | article |
| Idioma: | eng |
| Publicado em: |
2003
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| Assuntos: | |
| Texto completo: | http://hdl.handle.net/10316/5169 |
| País: | Portugal |
| Oai: | oai:estudogeral.sib.uc.pt:10316/5169 |