From ccl@www.ccl.net Mon Mar 31 11:33:02 1997 Received: from bedrock.ccl.net for ccl@www.ccl.net by www.ccl.net (8.8.3/950822.1) id LAA29430; Mon, 31 Mar 1997 11:28:46 -0500 (EST) Received: from admiral.umsl.edu for wwelsh@jinx.umsl.edu by bedrock.ccl.net (8.8.3/950822.1) id LAA05147; Mon, 31 Mar 1997 11:28:43 -0500 (EST) Received: from chewwels.umsl.edu ([134.124.77.29]) by admiral.umsl.edu (8.8.5/8.7.2) with SMTP id KAA05380 for ; Mon, 31 Mar 1997 10:28:40 -0600 (CST) Date: Mon, 31 Mar 1997 10:28:40 -0600 (CST) Message-Id: <199703311628.KAA05380@admiral.umsl.edu> X-Sender: wwelsh@jinx.umsl.edu X-Mailer: Windows Eudora Light Version 1.5.2 Mime-Version: 1.0 Content-Type: text/plain; charset="us-ascii" To: chemistry@ccl.net From: William Welsh Subject: band structures in 3D Dear Netters, Can someone point me to programs available for calculating electronic band structures in 1-, 2-, and 3- dimensions? I remember a few years back that a program known as VEH (Valence Effective Hamiltonian) was capable of doing this, but there may be others (or updated versions of VEH). I would be interested in both semi-empirical and ab initio programs. Thanks ... Prof. Bill Welsh Dept. of Chemistry University of Missouri-St. Louis