CCL:G: ERROR FREQUENCY CALCULATIONS

From: Carlos Pereira <carlosps1985###gmail.com>
Subject: CCL:G: ERROR FREQUENCY CALCULATIONS
Date: Thu, 20 Aug 2009 16:46:34 -0300

HELP-ME PLEASE...

FIRST ERROR

=====================================================================
INPUT
=====================================================================

%chk=C:\Users\carlos\Desktop\Calculos\4alinhaFREQ.chk
%rwf=a,245mw,b,245mw,c,245mw,d,245mw,e,245mw,f,245mw,g,245mw,h,245mw
#p opt freq b3lyp/lanl2dz scf=(maxcycle=600) test MaxDisk=1960MW

...

=====================================================================
WINDOW IN WIN VISTA
=====================================================================

Severe Error Message # 2070

The processing of the last link ended abnormally.
All processing has been aborted.

=====================================================================
OUTPUT
=====================================================================

Leave Link 1110 at Wed Aug 19 19:18:05 2009, MaxMem=    6291456 cpu:   10541.0
(Enter C:\G03W\l1002.exe)
Minotr: Closed-shell wavefunction.
          Direct CPHF calculation.
          Solving linear equations simultaneously.
          Differentiating once with respect to electric field.
                with respect to dipole field.
          Differentiating once with respect to nuclear coordinates.
          Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.
          Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.
          NewPWx=T KeepS1=F KeepF1=F KeepIn=T MapXYZ=F.
          MDV=       6291456 using IRadAn=       2.
Not enough memory in AlgDDF.
Error termination via Lnk1e in C:\G03W\l1002.exe at Wed Aug 19 19:18:32 2009.
Job cpu time: 0 days 2 hours 58 minutes 41.0 seconds.
File lengths (MBytes): RWF=    209 Int=      0 D2E=      0 Chk=     18 Scr=      1
=====================================================================

OTHER ERROR...

=====================================================================
INPUT
=====================================================================
%chk=C:\Users\carlos\Desktop\Calculos\4aFREQ.chk
%rwf=a,245mw,b,245mw,c,245mw,d,245mw,e,245mw,f,245mw,g,245mw,h,245mw
#p opt freq b3lyp/lanl2dz scf=(maxcycle=600) test MaxDisk=1960MW

...

=====================================================================
OUTPUT
=====================================================================

...

Leave Link 1110 at Thu Aug 20 01:05:47 2009, MaxMem=    6291456 cpu:   10601.0
(Enter C:\G03W\l1002.exe)
Minotr: Closed-shell wavefunction.
          Direct CPHF calculation.
          Solving linear equations simultaneously.
          Differentiating once with respect to electric field.
                with respect to dipole field.
          Differentiating once with respect to nuclear coordinates.
          Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.
          Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.
          NewPWx=T KeepS1=F KeepF1=F KeepIn=T MapXYZ=F.
          MDV=       6291456 using IRadAn=       2.
Not enough memory in AlgDDF.
Error termination via Lnk1e in C:\G03W\l1002.exe at Thu Aug 20 01:06:14 2009.
Job cpu time: 0 days 2 hours 59 minutes 46.0 seconds.
File lengths (MBytes): RWF=    209 Int=      0 D2E=      0 Chk=     18 Scr=      1

--
Carlos Pereira da Silva
http://Carlosps.110mb.com
carlosps1985[ AT ]gmail.com
(86)99223852