[molpro-user] transitions between spin-orbit of different electronic states

Joumana Assaf joumana.assaf at ed.univ-lille1.fr
Tue Nov 13 13:27:18 GMT 2012


Hi,
Please, Is there any command to find the magnitude of transition  
dipole moments between spin-orbites of elctronic states ? if yes ,  
what should I write in my imput file.
Notice that I got only transition diople moments between the  
electronic states by MCSCF and MRCI calculation.

thank you in advance

joumana Assaf
PHD student at university of Lille1-France




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