From owner-chemistry@ccl.net Tue Mar 24 05:42:00 2009 From: "Anindita De anindita/./iitk.ac.in" To: CCL Subject: CCL:G: J calculation Message-Id: <-38916-090324035610-21633-FwP/soB0O1X1jLrZz765Yg{:}server.ccl.net> X-Original-From: "Anindita De" Date: Tue, 24 Mar 2009 03:56:05 -0400 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, Anindita