dipole moment

Started by shima, November 18, 2007, 11:01:51 AM

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shima

Hi,

Do you know if the dipole moment in TURBOMOLE is defined from (-) to (+)
as in GAUSSIAN?
Is there any simplw way to visualize it?

thanks,

shima

zelsan

Hi,
Sorry, I don't know answer to your question, I am actually hoping you could help me.
I don't know how to calculate electric dipol moment in excited states. (not transition dipol moment, but just electric dipol moment). If you know, could you please help me?

Greetings!