From chemistry-request- at -server.ccl.net Wed Nov 1 12:47:03 2000 Received: from post2.inre.asu.edu (post2.inre.asu.edu [129.219.110.73]) by server.ccl.net (8.8.7/8.8.7) with ESMTP id MAA32198 for ; Wed, 1 Nov 2000 12:47:02 -0500 From: Benjamin.Moritz:~at~:asu.edu Received: from conversion.post2.inre.asu.edu by asu.edu (PMDF V6.0-24 #47347) id <0G3C00H01WBAMZ ^%at%^ asu.edu> for chemistry ^%at%^ ccl.net; Wed, 01 Nov 2000 10:23:34 -0700 (MST) Received: from general2.asu.edu (general2.asu.edu [129.219.10.242]) by asu.edu (PMDF V6.0-24 #47347) with ESMTP id <0G3C00GP7WBAHQ#* at *#asu.edu> for chemistry \\at// ccl.net; Wed, 01 Nov 2000 10:23:34 -0700 (MST) Received: from localhost (localhost [127.0.0.1]) by general2.asu.edu (8.9.3/8.9.3) with ESMTP id KAA03628 for ; Wed, 01 Nov 2000 10:23:33 -0700 (MST) Date: Wed, 01 Nov 2000 10:23:33 -0700 (MST) Subject: Transition Metals for G98 X-Sender: bmoritz -8 at 8- general2.asu.edu To: chemistry[ AT ]ccl.net Message-id: MIME-version: 1.0 Content-type: TEXT/PLAIN; charset=US-ASCII I was wondering if anyone has had trouble running transition metals in G98. I'm trying to run calculations with Hg but my error message keeps stating that the basis set won't work because the atomic number is out of range. Is there any way to correct for this? Thanks. Benjamin J. Moritz Chemical & Materials Engineering Arizona State University Mailto:bmoritz _-at-_)asu.edu