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Re^2: Want to increase memory

kaushik hatua
kaushikchemhatua@gmail.com

On Fri Mar 2 '12 3:06pm, Alex Granovsky wrote
---------------------------------------------
>Hi,

>could you please copy and paste here the first 200 lines of the output
>file. This would be helpful to identify problem.

>Kind regards,
>Alex Granovsky
>
>
>On Thu Mar 1 '12 6:20pm, kaushik hatua wrote
>--------------------------------------------
>>i use windows 64 bit 2008 server edition with 20GB RAM and 300 GB hard disk. i cant set MWORDS not greater than 100. i need some clue.

******************************************************
*Firefly (PC GAMESS) version 7.1.G, build number 5618*
* Compiled on Thursday, 26-11-2009, 20:43:46 *
*Code development and Intel/AMD specific optimization*
* Copyright (c) 1994, 2009 by Alex A. Granovsky, *
* Firefly Project, Moscow, Russia. *
* Some parts of this program include code due to *
* work of Jim Kress, Peter Burger, and Robert Ponec. *
******************************************************
* Firefly Project homepage: *
* http://classic.chem.msu.su/gran/firefly/index.html http://classic.chem.msu.su/gran/firefly/index.html *
* e-mail: *
* gran@classic.chem.msu.su *
* This program may not be redistributed without *
* the specific, written permission of its developers.*
******************************************************

******************************************************
* PARTIALLY BASED ON GAMESS (US) VERSION 6 JUN 1999, *
* GAMESS (US) VERSIONS 6 SEP 2001 AND 12 DEC 2003 *
* FROM IOWA STATE UNIVERSITY *
* M.W.SCHMIDT, K.K.BALDRIDGE, J.A.BOATZ, S.T.ELBERT, *
* M.S.GORDON, J.H.JENSEN, S.KOSEKI, N.MATSUNAGA, *
* K.A.NGUYEN, S.J.SU, T.L.WINDUS, *
* TOGETHER WITH M.DUPUIS, J.A.MONTGOMERY *
* J.COMPUT.CHEM. 14, 1347-1363(1993) *
******************************************************

Core i7 / Win32 Firefly version running under Windows NT
Running on Intel CPU: Brand ID 0, Family 6, Model 26, Stepping 5
CPU Brand String : Intel(R) Xeon(R) CPU E5506 @ 2.13GHz
CPU Features : CMOV, MMX, SSE, SSE2, SSE3, SSSE3, SSE4.1, SSE4.2, HTT, MWAIT, EM64T
Data cache size : L1 32 KB, L2 256 KB, L3 4096 KB
max # of cores/package : 8
max # of threads/package : 16
max cache sharing level : 16
actual # of cores/package : 4
actual # of threads/package : 4
actual # of threads/core : 1
Operating System successfully passed SSE support test.

PARALLEL VERSION (UNIFIED) RUNNING IN SERIAL MODE USING SINGLE PROCESS

WARNING! YOU ARE USING OUTDATED VERSION OF THE FIREFLY!
PLEASE CHECK FIREFLY HOMEPAGE FOR INFORMATION ON UPDATES!

EXECUTION OF FIREFLY BEGUN 10:17:43 LT 24-FEB-2012

ECHO OF THE FIRST FEW INPUT CARDS -
INPUT CARD>! ================================================================
INPUT CARD>! Input file for FireFly
INPUT CARD>! ================================================================
INPUT CARD> $SYSTEM MWORDS=300 $END
INPUT CARD> $CONTRL RUNTYP=FField NOSYM=1 $END
INPUT CARD> $CONTRL SCFTYP=RHF $END
INPUT CARD> $CONTRL MAXIT=130 $END
INPUT CARD> $FFCALC EFIELD=0.003 IAXIS=3 $END
INPUT CARD> $CONTRL MPLEVL=2 $END
INPUT CARD> $CONTRL ICHARG=0 MULT=1 $END
INPUT CARD> $BASIS GBASIS=ACCT EXTFIL=.T. $END
INPUT CARD> $DATA
INPUT CARD>Molecule specification
INPUT CARD>Dnh 2
INPUT CARD>
INPUT CARD>H 1.000000 -0.920980 1.262221 1.815237
INPUT CARD>C 6.000000 0.000000 0.721883 1.608695
INPUT CARD>Be 4.000000 0.000000 0.000000 0.000000
INPUT CARD> $END
300000000 WORDS OF MEMORY UNAVAILABLE

CPU TIME: STEP = 0.00 , TOTAL = 0.2 SECONDS ( 0.0 MIN)
WALL CLOCK TIME: STEP = 0.00 , TOTAL = 0.0 SECONDS ( 0.0 MIN)
CPU UTILIZATION: STEP = 0.00%, TOTAL = 5002.85%

WARNING! YOU ARE USING OUTDATED VERSION OF THE FIREFLY!
PLEASE CHECK FIREFLY HOMEPAGE FOR INFORMATION ON UPDATES!

EXECUTION OF FIREFLY TERMINATED ABNORMALLY AT 10:17:43 LT 24-FEB-2012

Sat Mar 3 '12 5:54am

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