CCL:G: TDDFT in G03
- From: Evgeniy Gromov
<Evgeniy.Gromov*tc.pci.uni-heidelberg.de>
- Subject: CCL:G: TDDFT in G03
- Date: Sun, 20 Nov 2005 19:28:52 +0100
Sent to CCL by: Evgeniy Gromov [Evgeniy.Gromov]~[tc.pci.uni-heidelberg.de]
Dear All,
I wonder whether it is possible to perform TDDFT
calculation for excited states using Gaussian03.
I did not find any proper keyword at Gaussian web
page. I will very appreciate if someone shows me
an example of Gaussian input for a TDDFT
calculation. Thanks a lot!
Best,
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 : tc.pci.uni-heidelberg.de
_______________________________________