From zdenko@masc1.rice.edu  Sat Nov 21 08:20:43 1992
Date: Sat, 21 Nov 92 14:20:43 CST
From: zdenko@masc1.rice.edu (Zdenko Tomasic)
Message-Id: <9211212020.AA06157@masc1.rice.edu>
To: Louis.Grace@um.cc.umich.edu
Subject: Gaussian 90/92 calculations


have you remembered to use overlap ? AO's are noy in general mutually
orthogonal. You may need something like a Mulliken population analysis
to handle that right.