TURBOMOLE Users Forum
TURBOMOLE Modules => Escf and Egrad => Topic started by: arek1arek on April 11, 2008, 09:39:48 PM
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Dear All,
Is it possible to calculate the transition dipole moment between two excited states with Turbomole?
Arek
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At which level? DFT, SCF, CIS, CC2?
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I'm sorry if I update this old post, however, since the question remained unsolved and since i am interested in sos expressions like < e | mu | e' >, e and e' being excited states, I'll ask that question again: is there a way (TM510 or TM6.0) to get transition dipole moments between two excited states at DFT or CC2 level ?
Thank you all in advance.
amedeo
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For CC2 this will become available with the next release TM6.1.
Christof