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

[Tatiana Korona]

Dear Evgeniy,

The left components are also in TR*, just after the right components. You can 
take h2o_eomprop.test job, add "show,TR*" and you will see easily where they 
are.

Bes wishes,

Tatiana


On Thu, 19 May 2011, Evgeniy Gromov wrote:

> 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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Dr. Tatiana Korona http://tiger.chem.uw.edu.pl/staff/tania/index.html
Quantum Chemistry Laboratory
University of Warsaw
Pasteura 1, PL-02-093 Warsaw, POLAND


`The man who makes no mistakes does not usually make anything.'
                                        Edward John Phelps (1822-1900)