[CPMD-list] MEMORY ALLOCATION ERROR

Giacomo Saielli giacomo.saielli at unipd.it
Mon Aug 30 14:16:08 CEST 2004


... I hope three emails will be enough :)
this is finally the input file and the error message

&CPMD
   OPTIMIZE WAVEFUNCTION
&END
&SYSTEM
   SYMMETRY
    1
   CELL
    10.2612 1.0 1.0 0.0 0.0 0.0
   CUTOFF
    13.0
&END
&ATOMS
*SI_SGS KLEINMAN-BYLANDER
 LMAX=P
  8
       0.0   0.0    0.0   1
       0.0   5.13   5.13  1
       5.13  0.00   5.13  1
       5.13  5.13   0.00  1
       2.565 2.565  2.565 1
       2.565 7.695  7.695 1
       7.695 2.565  7.695 1
       7.695 7.695  2.565 1
&END

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

 ****************************************************************
 PROCESSOR     0 ALLOCATION OF       80320 WORDS OF MEMORY FAILED
 ****************************************************************

 ***    MEMORY| THE NEW SIZE OF THE PROGRAM IS    3060/  18952 kBYTES ***

 ================================================================
                      BIG MEMORY ALLOCATIONS
 NGHTOL               100                WGH                  100
 RGH                  100                WSG                  100
 NGHCOM               100                VELP                  24
 TAU0                  24                RCL                   12
 BL                    12                AL                    12
 ----------------------------------------------------------------
 [PEAK NUMBER   11]      PEAK MEMORY          593 =    0.0 MBytes
 ================================================================


 PROGRAM STOPS IN SUBROUTINE MEMORY| ALLOCATION FAILED (GNL) [PROC=   0]
[0] MPI Abort by user Aborting program !
[0] Aborting program!

Sorry about that!

thanks,

-- 
Giacomo Saielli
Istituto per la Tecnologia delle Membrane del CNR, Sezione di Padova;
Via Marzolo, 1 - 35131 Padova, Italy; 
Tel: +39-049-8275279; Fax: -5239;
http://www.chfi.unipd.it/home/g.saielli/




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