From owner-chemistry@ccl.net Sun Nov 20 23:36:00 2005 From: "Evgeniy Gromov Evgeniy.Gromov]=[tc.pci.uni-heidelberg.de" To: CCL Subject: CCL:G: TDDFT in G03 Message-Id: <-30016-051120132858-31166-gl69Iuwl/7JvsYOAvDJ0tg=server.ccl.net> X-Original-From: Evgeniy Gromov Content-Transfer-Encoding: 7bit Content-Type: text/plain; charset=us-ascii; format=flowed Date: Sun, 20 Nov 2005 19:28:52 +0100 MIME-Version: 1.0 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 _______________________________________