Subject: X3LYP

From: <crice=at=gwdg.de>
Date: Tue, 01 Jun 2004 19:10:25 +0200

Dear everyone,

I was wondering if anyone had any information on how to run X3LYP calculations
described by Xin Xu and William Goddard III  in any other program besides
JAGUAR. This extended density functional seems very interesting to me, and if
it describes hydrogen bonding much better than B3LYP, it would be a much
faster and better DFT method. 

Thanks,

Corey Rice

Institut fuer Physikalische Chemie
Georg-August-Universitaet
Tammannstrasse 6
D-37077 Goettingen
Tel: (49)-551-3914322
Fax: (49)-551-39 3117
Email: crice=at=gwdg.de