CCL:G: J calculation
- From: Vincent Xianlong Wang <xloongw() yahoo.com>
- Subject: CCL:G: J calculation
- Date: Sun, 29 Mar 2009 08:09:13 -0700 (PDT)
Sent to CCL by: Vincent Xianlong Wang [xloongw_+_yahoo.com]
Hi Anindita,
Please see the following tutorial from Gaussian.com
http://www.gaussian.com/g_news/sum05/newsletter_g03_tips.htm
Vincent
----- Original Message ----
> From: Anindita De anindita/./iitk.ac.in <owner-chemistry]-[ccl.net>
To: "Wang, Xianlong " <xloongw]-[yahoo.com>
Sent: Tuesday, March 24, 2009 3:56:05 PM
Subject: CCL:G: J calculation
Sent to CCL by: "Anindita De" [anindita,,iitk.ac.in]
Dear All,
I want to determine the J value of an antiferromagnetically coupled dimer using
Gaussian 03 programme.Can anyone tell me how to do it ?
Regards,
Aninditahttp://www.ccl.net/cgi-bin/ccl/send_ccl_messagehttp-:-//www.ccl.net/chemistry/sub_unsub.shtmlhttp-:-//www.ccl.net/spammers.txt