[molpro-user] Where are left and right transition dipole moments calculated with eom-ccsd stored?

Evgeniy Gromov Evgeniy.Gromov at pci.uni-heidelberg.de
Thu May 19 18:42:27 BST 2011


Dear Molpro Community,

I am wondering what variables are reserved for the
left and right components of the transition dipole
moment calculated in the EOM-CCSD procedure. Actually
I learned that the right TDM components are stored in
TDMX, TDMY and TDMZ but what about the left components.
Many thanks!

Best regards,
Evgeniy

-- 
_______________________________________
Dr. Evgeniy Gromov
Theoretische Chemie
Physikalisch-Chemisches Institut
Im Neuenheimer Feld 229
D-69120 Heidelberg
Germany

Telefon: +49/(0)6221/545263
Fax: +49/(0)6221/545221
E-mail: evgeniy at pci.uni-heidelberg.de
_______________________________________






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