From owner-chemistry@ccl.net Mon Feb 20 08:18:01 2012
From: "Dr. Torsten Bruhn torsten.bruhn-$-uni-oldenburg.de" <owner-chemistry-$-server.ccl.net>
To: CCL
Subject: CCL:G: AW: CCL:G: Computational Chemistry
Message-Id: <-46340-120220044037-23875-+o5OBk77QXrEBhaqmbbjVg-$-server.ccl.net>
X-Original-From: "Dr. Torsten Bruhn" <torsten.bruhn^uni-oldenburg.de>
Content-Language: de-DE
Content-Transfer-Encoding: 8bit
Content-Type: text/plain; charset="us-ascii"
Date: Mon, 20 Feb 2012 09:40:26 +0000
MIME-Version: 1.0


Sent to CCL by: "Dr. Torsten Bruhn" [torsten.bruhn:-:uni-oldenburg.de]
Try SpecDis:

http://www-organik.chemie.uni-wuerzburg.de/lehrstuehlearbeitskreise/bringmann/specdis/

best regards,

Torsten


________________________________________
Von: owner-chemistry+torsten.bruhn==mail.uni-oldenburg.de(0)ccl.net [owner-chemistry+torsten.bruhn==mail.uni-oldenburg.de(0)ccl.net]&quot; im Auftrag von &quot;Kalaivanan Nagarajan kalaichemis!=!gmail.com [owner-chemistry(0)ccl.net]
Gesendet: Montag, 20. Februar 2012 05:11
Bis: Dr. Torsten Bruhn
Betreff: CCL:G: Computational Chemistry

Sent to CCL by: "Kalaivanan  Nagarajan" [kalaichemis:+:gmail.com]
Dear all,
I am trying to simulate the ECD Spectrum for simple bichromophoric system using
Gaussian 09 software. I have done the calculation using TD-DFT. I dont know how
to get the ECD spectrum from the output. Can anyone of you help me to come out
of this problem? Thanks in advance.http://www.ccl.net/cgi-bin/ccl/send_ccl_messagehttp://www.ccl.net/chemistry/sub_unsub.shtmlhttp://www.ccl.net/spammers.txt