[molpro-user] Dummy atoms when using integral program Argos

Evgeniy Gromov Evgeniy.Gromov at pci.uni-heidelberg.de
Mon May 13 18:31:55 BST 2013


Dear Developers and Users of Molpro,

I wonder if it is possible to use dummy atoms with
the integral program Argos. I guess there might be
a different keyword for dummy in the case of Argos
as the usual way described in the manual is not working.

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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