Subject: Geometry Optimization Rookie question

From: José Gonçalo Deira Duarte Justino <jgjustino!at!fc.ul.pt>
Date: Thu, 26 Feb 2004 14:02:24 -0000

Hi u all!

Just a simple question: what method would u use to calculate bond angles and lenghts and similar of compounds like 1-phenyl-antracene? Any sugestions welcome are - I've tried semi-empirical (AM1 and PM3) but I'm somewhat disastified with the results!

Cheers,
Tino