Transition dipole moment

15 views
Skip to first unread message

Maksim Shundalau

unread,
Feb 22, 2021, 3:05:30 PMFeb 22
to dirac-users

Dear Dirac experts,

 

Maybe my question is trivial, but I can’t understand how to calculate transition dipole moments at the FS-CCSD level of theory. Should I use linear response theory or finite field method? Or something else? Could you please suggest a test, example, or some instructions for solving this problem?

 

Sincerely yours,

Maksim.

Reply all
Reply to author
Forward
0 new messages