From owner-chemistry@ccl.net Fri Nov 18 07:59:00 2011 From: "Rosana Marques Amorim amorimrm,+,superig.com.br" To: CCL Subject: CCL:G: Fragment calculation Message-Id: <-45897-111117212609-18939-363K16slFY08/Y/ryawORQ(-)server.ccl.net> X-Original-From: "Rosana Marques Amorim" Content-Transfer-Encoding: 7bit Content-Type: text/plain; format=flowed; charset="iso-8859-1"; reply-type=original Date: Fri, 18 Nov 2011 00:25:57 -0200 MIME-Version: 1.0 Sent to CCL by: "Rosana Marques Amorim" [amorimrm++superig.com.br] Partha, I think you can use onion calculation to do this. Rosana Amorim -------------------------------------------------- > From: "Partha P Kundu partha1kundu[A]yahoo.com" Sent: Thursday, November 17, 2011 4:12 PM To: "Amorim, Rosana " Subject: CCL:G: Fragment calculation > > Sent to CCL by: "Partha P Kundu" [partha1kundu=-=yahoo.com] > Dear All, > I want to optimize a structure with different charge on different parts of > system. Is it possible to do in Gaussian 03? > Thanks in advance. > Partha.> >