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To: chemistry-!at!-ccl.net
From: William Welsh <wwelsh {*at*} jinx.umsl.edu>
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