Corentin Poidevin
corentin.poidevin@lcc-toulouse.fr
Best regards,
Corentin Poidevin
On Tue Jun 18 '13 8:04pm, Alex Granovsky wrote
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>Dear Corentin,
>With Firefly, it is possible to compute them using CIS,
>TDHF, TDDFT, GUGA CI, MCSCF, MCQDPT2, and XMCQDPT2.
>Kind regards,
>Alex Granovsky
>
>
>On Mon Jun 17 '13 12:20pm, Corentin Poidevin wrote
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>>Dear all,
>>I would like to know how the calculation of the transition dipole moments between excited states is implemented in Firefly?
>>Thank you
>>Best regards
>>Corentin Poidevin
>>LCC, Toulouse
>>France