Subject: summary mp2/cc-pvtz

From: Alessandro Contini <alessandro.contini!at!unimi.it>
Date: Thu, 06 Nov 2003 17:07:11 +0100 (CET)

Hi,
I'd like to thanks Marcel Swart, Stephen Garrison, Olga Dmitrenko and
Giovanni Scalmani for the kind reply.
The problem as suggested was derived by a "out of disk" or "out of memory"
error (the famous -1); however I could not solve it because the disk
requested for my system was 280GB and more for a semidirect and at least
25GB of memory for a direct optimization. However the calculation run
properly with B3LYP/cc-pvtz, B3LYP/tzvp and B3LYP/6-311+G(2d,p) basis.

Thanks again

Alessandro Contini

Alessandro Contini, Ph.D.
Istituto di Chimica Organica "Alessandro Marchesini"
Universit` degli Studi di Milano, Facolt` di Farmacia
Via Venezian, 21 20133 Milano
Tel. +390250314480 Fax. +390250314476
e-mail alessandro.contini!at!unimi.it