[CPMD-list] hi

[haider abbas]

Dear all cpmd user,

my output file shows massage

                       The CPMD consortium      
                    WWW:   http://www.cpmd.org
                 Mailinglist:   cpmd-list at cpmd.org
                     E-mail:   cpmd at cpmd.org


                  ***  May 24 2004 -- 15:14:55  ***

 THE INPUT FILE IS:                                   
     inp-1
 THIS JOB RUNS ON:                                    
   falcon5
 THE CURRENT DIRECTORY IS: 
                                  
/home/haider/CPMD-3.7.2/SOURCE
 THE TEMPORARY DIRECTORY IS: 
                                  
/home/haider/CPMD-3.7.2/SOURCE
 THE PROCESS ID IS:                                   
      5622
 THE JOB WAS SUBMITTED BY:                            
    haider
 
       THE FOLLOWING OPTIONS ARE MUTUALLY  EXCLUSIVE 
                                  MOLECULAR DYNAMICS 
                               GEOMETRY OPTIMIZATION 
                           WAVEFUNCTION OPTIMIZATION 
                                  KOHN-SHAM ENERGIES 
                                VIBRATIONAL ANALYSIS 
                                          PROPERTIES 
                                    ORBITAL HARDNESS 
                                  ELECTRONIC SPECTRA 
                                        DEBUG FORCES 
                                     LINEAR RESPONSE 
                                 CLASSICAL INTERFACE 


 PROGRAM STOPS IN SUBROUTINE CONTROL| RUNOPTIONS 
999


with the input file which is just a sample



&CPMD
 OPTIMIZE WAVEFUNCTION
 MAXSTEP
 500
 MOLECULAR DYNAMICS
 RESTART WAVEFUNCTION COORDINATES VELOCITIES LATEST
 TIMESTEP
 4
 TEMPERATURE
 3000
 MAXSTEP
 500
 PCG NOPRECONDITIONING
 QUENCH ELECTRONS BO
 MAXSTEP
 100
 STORE
 450
 TIMESTEP
 6.0
 EMASS
 900
 TRAJECTORY SAMPLE
 10
 MOVIE
 50
 RESTFILE
 2
 STRUCTURE BONDS ANGLES DIHEDRALS
&END
&SYSTEM
  SYMMETRY
  1
  CELL
  10.558 1.0 1.0 0.0 0.0 0.0
  CUTOFF
  70.0
&END
&ATOMS
 *O_SG_BLYP
  LMAX=P LOC=P
  32
  -0.36687   0.51547   0.03858       
   0.04654   0.42373  -0.04132       
  -0.13264   0.09788  -0.49158       
  -0.25283  -0.25274   0.45476       
   0.43036   0.11249  -0.04015       
   0.23774  -0.24561   0.02796       
  -0.28373  -0.34919  -0.26897       
  -0.15847   0.32543  -0.31740       
   0.50630   0.41162   0.27446       
   0.41580  -0.04854   0.19495       
   0.08208  -0.04073  -0.26788       
  -0.08967   0.16763   0.10464       
   0.36541   0.04422  -0.37853       
  -0.24265   0.30156  -0.06024       
   0.00047  -0.24284   0.35250       
   0.09506  -0.55455  -0.36671       
   0.39353  -0.24187  -0.21652       
  -0.42713  -0.05290   0.43525       
  -0.38096   0.41897   0.54761       
   0.37563   0.34558  -0.33718       
   0.11451  -0.45557   0.22547       
   0.17722   0.02419   0.34017       
   0.37501  -0.36704   0.39345       
  -0.35986   0.04083  -0.16910       
  -0.39713  -0.26661   0.19022       
   0.19576  -0.28820  -0.40144       
   0.28723   0.26210   0.22348       
  -0.11113   0.30823   0.31810       
  -0.05683  -0.20771  -0.10124       
   0.11165   0.12286  -0.05824       
  -0.24203  -0.06256   0.05471       
   0.37397   0.38911  -0.07478
 *SI_SG_LDA
  LMAX=P LOC=P
   16    
  0.000    0.250    0.250
  0.250    0.000    0.250
  0.250    0.250    0.000
  0.125    0.125    0.125
  0.125    0.375    0.375
  0.375    0.125    0.375
  0.375    0.375    0.125
  0.500    0.000    0.000
  0.500    0.250    0.250
  0.750    0.000    0.250
  0.750    0.250    0.000
  0.625    0.125    0.125
  0.625    0.375    0.375
  0.875    0.125    0.375
  0.875    0.375    0.125
  0.000    0.500    0.000
&END

&DFT
  LDA CORRELATION LYP
  GRADIENT CORRECTION BECKE88 LYP
    1.D-8
    EXCHANGE CORRELATION TABLE
    30000 2.0D0             
&END    
 
how can i fix this problem
thanks
Haider Abbas

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