Dear Sergio;
Is there possible to send the
output file? I can't find any error in this input section.
Sincerely
------------------------------------------------------------------------------------------------------------------------------
`The
man who makes no mistakes does not usually make anything.'
Edward John Phelps (1822-1900)
------------------------------------------------------------------------------------------------------------------------------
Mehdi D. Esrafili, Ph.D.
Assistant Professor of Physical
Chemistry
Current address: Department of Chemistry,
Faculty of Basic Sciences,University
of
Margheh, Iran.
------------------------------------------------------------------------------------------------------------------------------
From: sergio.manzetti(!)gmail.com
<owner-chemistry**ccl.net>
To: "Esrafili, Mehdi D " <m_esrafili**yahoo.com>
Sent: Saturday, February 25, 2012
8:05 PM
Subject: CCL:G: Error
in command line
Dear CCLrs, I submitted the wrong input
in the previous mail. The right one is this:
%nproc=4
%Mem=1900MB
#P MPW1PW91/6-311+G(d)/auto scrf=(solvent=water)
# Opt
# polar
# Gfinput IOP(6/7=3) Pop=full Density Test
# Units(Ang,Deg)
I still get a reply from G03 stating
:
Error parsing percent card:
QPERR --- A SYNTAX ERROR WAS DETECTED IN THE INPUT LINE.
Sergio