好不容易安裝好了Gaussian09，但是一運(yùn)行進(jìn)程就被killed，輸入文件都能正常讀，還能出chk和log文件，但在終端上就是現(xiàn)實(shí)killed，不知道是什么原因，是gaussian程序問(wèn)題么

Entering Gaussian System, Link 0=g09

Input=H2O_test.gjf

Output=H2O_test.log

Initial command:

/root/g09/l1.exe /root/g09/scratch/Gau-6896.inp -scrdir=/root/g09/scratch/

Entering Link 1 = /root/g09/l1.exe PID=? ?? ?6898.

Copyright (c) 1988,1990,1992,1993,1995,1998,2003,2009,2011,

Gaussian, Inc.??All Rights Reserved.

This is part of the Gaussian(R) 09 program.??It is based on

the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.),

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 competitor of

Gaussian, Inc. access to this program.??By using this program,

the user acknowledges that Gaussian, Inc. is engaged in the

business of creating and licensing software in the field of

computational chemistry and represents and warrants to the

licensee that it is not a competitor of Gaussian, Inc. and that

it will not use this program in any manner prohibited above.

---------------------------------------------------------------

Cite this work as:

Gaussian 09, Revision C.01,

M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria,

M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, B. Mennucci,

G. A. Petersson, H. Nakatsuji, M. Caricato, X. Li, H. P. Hratchian,

A. F. Izmaylov, J. Bloino, G. Zheng, J. L. Sonnenberg, M. Hada,

M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima,

Y. Honda, O. Kitao, H. Nakai, T. Vreven, J. A. Montgomery, Jr.,

J. E. Peralta, F. Ogliaro, M. Bearpark, J. J. Heyd, E. Brothers,

K. N. Kudin, V. N. Staroverov, T. Keith, R. Kobayashi, J. Normand,

K. Raghavachari, A. Rendell, J. C. Burant, S. S. Iyengar, J. Tomasi,

M. Cossi, N. Rega, J. M. Millam, M. Klene, J. E. Knox, 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,

R. L. Martin, K. Morokuma, V. G. Zakrzewski, G. A. Voth,

P. Salvador, J. J. Dannenberg, S. Dapprich, A. D. Daniels,

O. Farkas, J. B. Foresman, J. V. Ortiz, J. Cioslowski,

and D. J. Fox, Gaussian, Inc., Wallingford CT, 2010.

******************************************

Gaussian 09:??EM64L-G09RevC.01 23-Sep-2011

2-Jul-2016

******************************************

%chk=H2O_test.chk

-----------------------------------

# opt b3lyp/3-21g geom=connectivity

-----------------------------------

1/14=-1,18=20,19=15,26=3,38=1,57=2/1,3;

2/9=110,12=2,17=6,18=5,40=1/2;

3/5=5,11=2,16=1,25=1,30=1,71=1,74=-5/1,2,3;

4//1;

5/5=2,38=5/2;

6/7=2,8=2,9=2,10=2,28=1/1;

7//1,2,3,16;

1/14=-1,18=20,19=15/3(2);

2/9=110/2;

99//99;

2/9=110/2;

3/5=5,11=2,16=1,25=1,30=1,71=1,74=-5/1,2,3;

4/5=5,16=3/1;

5/5=2,38=5/2;

7//1,2,3,16;

1/14=-1,18=20,19=15/3(-5);

2/9=110/2;

6/7=2,8=2,9=2,10=2,19=2,28=1/1;

99/9=1/99;

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