From chemistry-request@server.ccl.net Sun Jun 23 21:02:58 2002 Received: from hotmail.com ([64.4.15.196]) by server.ccl.net (8.11.6/8.11.0) with ESMTP id g5O12wQ19933 for ; Sun, 23 Jun 2002 21:02:58 -0400 Received: from mail pickup service by hotmail.com with Microsoft SMTPSVC; Sun, 23 Jun 2002 18:02:53 -0700 Received: from 133.11.92.210 by lw10fd.law10.hotmail.msn.com with HTTP; Mon, 24 Jun 2002 01:02:53 GMT X-Originating-IP: [133.11.92.210] From: "warau kimura" To: chemistry@ccl.net Subject: CPCM in Gaussian Date: Mon, 24 Jun 2002 10:02:53 +0900 Mime-Version: 1.0 Content-Type: text/plain; format=flowed Message-ID: X-OriginalArrivalTime: 24 Jun 2002 01:02:53.0630 (UTC) FILETIME=[DE873DE0:01C21B1A] Dear all, I would like to ask for help. I am using CPCM model implemented in Gaussian 98 A.11 to do geometry optimization calculation. However, the following message appears in the output file and it is very difficult to get convergent. How can I solve this problem? Thanks a lot. Warning: nuclear charge 365 neglected Warning: nuclear charge 510 neglected Warning: electronic charge 365 neglected Warning: electronic charge 510 neglected Yours Sincerely, Kimura The Department of Quantum Engineering and Systems Sciences The University of Tokyo Japan _________________________________________________________________ MSN Photos is the easiest way to share and print your photos: http://photos.msn.com/support/worldwide.aspx