Sent to CCL by: "Aimee Tomlinson"
[altomlinson*o*ngcsu.edu]
I have seen this error before and it was a problem
with linking. I cannot identify what the problem is this time. It seems to
break down upon inclusion of larger atom (e.g. Sulfur). I tried to run a
simple calculation on thiophene and here is the log file:
Entering Link
1 =
C:\G03W\l1.exe PID= 3240.
Copyright (c)
1988,1990,1992,1993,1995,1998,2003,2004, Gaussian, Inc.
All Rights Reserved.
This is the Gaussian(R) 03 program. It is based on the
the Gaussian(R)
98 system (copyright 1998, Gaussian, Inc.),
the Gaussian(R) 94 system
(copyright 1995, Gaussian, Inc.),
the Gaussian 92(TM) system (copyright
1992, Gaussian, Inc.),
the Gaussian 90(TM) system (copyright 1990, Gaussian,
Inc.),
the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.),
the
Gaussian 86(TM) system (copyright 1986, Carnegie Mellon
University), and the
Gaussian 82(TM) system (copyright 1983,
Carnegie Mellon University).
Gaussian is a federally registered
trademark of Gaussian, Inc.
This software contains proprietary and confidential information,
including trade secrets, belonging to
Gaussian, Inc.
This software is provided under written license
and may be
used, copied, transmitted, or stored only in accord with that
written license.
The following legend is applicable only to US
Government
contracts under FAR:
RESTRICTED RIGHTS LEGEND
Use, reproduction and disclosure by the US Government is
subject to
restrictions as set forth in subparagraphs (a)
and (c) of the Commercial
Computer Software - Restricted
Rights clause in FAR 52.227-19.
Gaussian, Inc.
340 Quinnipiac St., Bldg. 40, Wallingford CT
06492
---------------------------------------------------------------
Warning --
This program may not be used in any manner that
competes with the business
of Gaussian, Inc. or will provide
assistance to any competitor of Gaussian,
Inc. The licensee
of this program is prohibited from giving any
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Gaussian, Inc. access to this program. By using this
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the user acknowledges that Gaussian, Inc. is engaged in the
business of creating and licensing software in the field of
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---------------------------------------------------------------
Cite this work as:
Gaussian 03, Revision D.01,
M. J. Frisch, G.
W. Trucks, H. B. Schlegel, G. E.. Scuseria,
M. A. Robb, J. R. Cheeseman, J.
A. Montgomery, Jr., T. Vreven,
K. N. Kudin, J. C. Burant, J. M. Millam, S.
S. Iyengar, J. Tomasi,
V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N.
Rega,
G. A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota,
R.
Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao,
H. Nakai,
M. Klene, X. Li, J. E. Knox, H. P. Hratchian, J. B. Cross,
V. Bakken, C.
Adamo, J. Jaramillo, R. Gomperts, R. E. Stratmann,
O. Yazyev, A. J. Austin,
R. Cammi, C. Pomelli, J. W. Ochterski,
P. Y. Ayala, K. Morokuma, G. A.
Voth, P. Salvador, J. J. Dannenberg,
V. G. Zakrzewski, S. Dapprich, A. D.
Daniels, M. C. Strain,
O. Farkas, D. K. Malick, A. D. Rabuck, K.
Raghavachari,
J. B. Foresman, J. V. Ortiz, Q. Cui, A. G.. Baboul, S.
Clifford,
J. Cioslowski, B. B. Stefanov, G. Liu, A. Liashenko, P. Piskorz,
I. Komaromi, R. L. Martin, D. J. Fox, T. Keith, M. A.. Al-Laham,
C. Y.
Peng, A. Nanayakkara, M. Challacombe, P. M. W. Gill,
B. Johnson, W. Chen,
M. W. Wong, C. Gonzalez, and J. A. Pople,
Gaussian, Inc., Wallingford CT,
2004.
******************************************
Gaussian 03:
IA32W-G03RevD.01
13-Oct-2005
25-Sep-2009
******************************************
%mem=1500MB
%chk=C:\G03W\RAE\CON_A5a\thiophene.chk
---------------------------
# opt
am1 geom=connectivity
---------------------------
1/14=-1,18=50,26=3,38=1,57=2/1,3;
2/9=110,17=6,18=5,40=1/2;
3/5=2,11=9,12=1,16=1,25=1,30=1/1;
4/5=3,11=1,20=5,22=1,24=3,35=1/1,2;
6/7=2,8=2,9=2,10=2/1;
7//16;
1/14=-1,18=50/3(3);
2/9=110/2;
6/7=2,8=2,9=2,10=2/1;
99//99;
2/9=110/2;
3/5=2,11=9,12=1,16=1,25=1,30=1/1;
4/5=5,11=1,16=3,20=5,22=1,24=3,35=1/1,2;
7//16;
1/14=-1,18=50/3(-4);
2/9=110/2;
6/7=2,8=2,9=2,10=2/1;
99//99;
For some reason it
breaks down at the |1.exe.
Any help would be
appreciated.
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