Subject: CCL: Energy analysis?

From: Thomas Nowak <[email-masked]>
Date: Mon, 6 Jul 1998 17:20:11 +0200 (METDST)

Hi,

I am looking for program for the analysis of the bond energy.
I know there is one implementation of the Morokuma algorithm in ADF, so i
looking for other implementations of this or similar algorithm  which can
be used with other quantum chemistry programs. It would be great, if we
can do such analysis on DFT level.  

Regards,

Thomas Nowak 
Martin-Luther Universitaet Halle 
FB Chemie (Merseburg)  
IPC
06099 Halle

email: [email-masked]