Subject: Possible problem ...

From: "Alistair.Nelson" <[email-masked]>
Date: Wed, 4 Feb 1998 16:17:48 +0000 (GMT)

I am running GAMESS-UK and am doing MRDCI calculations on the rydberg
states of ozone. The problem is that in the selection program there are
negative values appearing, does anyone know what could be causing this? We
are using a TZVP with 3s2p2d basis set.

any help would be gratefully accepted

Alistair Nelson

[email-masked]