Subject: MOPAC:transition dipole

From: Sophie BRASSELET <[email-masked]>
Date: Mon, 18 Mar 1996 13:17:38 +0100

I am interested in the calculation of
transition dipole moments between the
excited states and excited state dipole
moments for various molecules. This possibility
is specified in the MOPAC capacities from
the MOPAC manual, but no further indication
is given. I would like to know if there is
a specific keyword for that in the program
or if it is necessary to make calculation
by ourselves from MOPAC results on 
molecular orbitals.
Thanks a lot for your attention!

Sophie Brasselet
PhD student in Molecular ingeneering
for non linear optic
Email: [email-masked]
Phone: 33 1 42317574
SMail: CNET
       196 av. H. Ravera
       92225 Bagneux[A[A[D[D[D[D[D[DPAB/BAG/CDP/EQM[B[B[B[B[D[D[D[D[D[D[D[D[D[D[D[D[C[C[C
[C[C[C[C[C[C[CFrance