From owner-chemistry@ccl.net Fri Feb 11 16:56:00 2011 From: "Jose P. Ceron jpceron^um.es" To: CCL Subject: CCL:G: solvent Message-Id: <-43937-110211165311-13012-Xepe/52SZEji7/uTnHkX+A.:.server.ccl.net> X-Original-From: "Jose P. Ceron" Date: Fri, 11 Feb 2011 16:53:09 -0500 Sent to CCL by: "Jose P. Ceron" [jpceron]![um.es] Dear Mahshid, In the case of PCM you should include scrf keyword as follows: # scrf=(pcm,solvent=X) where X is the selected solvent: X=n,n-DiMethylFormamide for dmf. Please, go to www.gaussian.com/g_tech/g_ur/k_scrf.htm for further information, examples and the list of defined solvents in Gaussian. Best, Jose Sent to CCL by: "MAHSHID - SABERINASAB" [saberinasabmahshid . yahoo.com] Hi all, I've sent massages for you several times,buttill nowI didn't reseave any answetrs.in the case of opting som input files via solvent method(PCM)I facewith some problems.about that solvent such as dmf which isnot mentioned in the calculation part of gauss view,how should I run its input in a way I don't resaev any error massage?would you mind helping me in this case? in advanse thanks for your attention regards M.Saberinasab