Subject: CCL: Energy accuracy for conformation calculation in Gaussian

From: Vincent Xianlong Wang <xloongw_at_yahoo.com>
Date: Wed, 29 Sep 2004 09:33:35 -0700 (PDT)

Dear CCLer,

The accuracies of model chemistries in Gaussian have
been discussed in 'Exploring Chemistry with Electronic
Structure Methods' by J.B. Foresman et al. I'm
wondering if the energy accuracy could go higher in
the calculation for the energy difference among
different conformers of certain molecule? 
Your comments and reference information are welcome#!

Vincent

__________________________________
Do you Yahoo!?
New and Improved Yahoo! Mail - Send 10MB messages!
http://promotions.yahoo.com/new_mail