I have performed the calculation to obtain a value of transition dipole moment
(mu(A), mu(B), mu(C)) using G03 program. The method and basis set which
I have used are CIS/6-31G**. A part of result(*.log) is as follow:
Ground to excited state Transition electric dipole moments (Au):
state X Y Z Osc.
1 0.0774 -0.7148 -0.1449 0.0758
I think, this result shows the coordinate and strength of transition dipole moment.
However, I want to know more specific data like a strength of mu of each axis-A, B, and C.
Does anybody knows the solution about this problem,
especially when performing calculation using G03?
It will be a good answer if you know the program or tools which can solve these problems.
What is unit which "Osc." term in upper result reveal?
Kwanyong Seo : (E-mail) blue_sky-: at :-kaist.ac.kr (first)
cupid-: at :-alkali.kaist.ac.kr
(MSN) chemist_sky-: at :-hotmail.com
Department of Chemistry
Korea Advanced Institute of Science & Technology
373-1, Guseong-dong, Yuseong-gu,
Taejon, Republic of Korea