[Pw_forum] error

george manyali gmanyali2005 at yahoo.com
Wed Dec 1 12:09:39 CET 2010


Dear all,
can someone tell me how to correct the error message below:

Warning: Permanently added 'cnode-1-13,172.17.200.13' (RSA) to the list of known 
hosts.
Warning: Permanently added 'cnode-1-6,172.17.200.6' (RSA) to the list of known 
hosts.
--------------------------------------------------------------------------
MPI_ABORT was invoked on rank 5 in communicator MPI_COMM_WORLD 
with errorcode 0.

NOTE: invoking MPI_ABORT causes Open MPI to kill all MPI processes.
You may or may not see output from other processes, depending on
exactly when Open MPI kills them.
--------------------------------------------------------------------------
--------------------------------------------------------------------------
mpirun has exited due to process rank 1 with PID 11311 on
node cnode-1-48 exiting without calling "finalize". This may
have caused other processes in the application to be
terminated by signals sent by mpirun (as reported here).
--------------------------------------------------------------------------
[cnode-1-48:11307] 15 more processes have sent help message help-mpi-api.txt / 
mpi-abort
[cnode-1-48:11307] Set MCA parameter "orte_base_help_aggregate" to 0 to see all 
help / error messages

here is my input file

&CONTROL
     calculation='vc-relax',
     tstress=.t.,tprnfor=.t.,
     outdir='/export/home/gmanyali/ASESMAPROJECT/Files-SiO2/tmp',
     pseudo_dir='/export/home/gmanyali/ASESMAPROJECT/XC_PSEUDO/PW91/'
     forc_conv_thr=1.d-5,
     !dt=30,
     !nstep=2000,
/
&SYSTEM
     ibrav=4,
     celldm(1)=9.289897331,
     celldm(3)=1.099552482,
     nat=  9, ntyp= 2,
     ecutwfc=90
/
&ELECTRONS
     mixing_mode = 'plain'
     mixing_beta = 0.7
     conv_thr =  1.0d-8
/
&IONS
     ion_dynamics='bfgs',
    ! ion_dynamics='damp',
/
&CELL
    press=0,
       cell_dynamics='bfgs',    
/
ATOMIC_SPECIES
  Si  10.0    Si_PW91.TM
  O   10.0    O_PW91.TM
ATOMIC_POSITIONS {crystal}
Si     0.469700000    0.000000000    0.000000000
Si     0.000000000    0.469700000    0.666666667
Si    -0.469700000   -0.469700000    0.333333333
O      0.413500000    0.266900000    0.115800000
O     -0.266900000    0.146600000    0.782466667
O     -0.146600000   -0.413500000    0.449133333
O      0.266900000    0.413500000    0.550866667
O     -0.413500000   -0.146600000    0.217533333
O      0.146600000   -0.266900000   -0.115800000
K_POINTS {automatic}
2 2 2 1 1 1
 Mr. George Simiyu Manyali
Postgraduate Student,
Physics Department,
Moi University-Chepkoilel Campus P.O BOX 1125,ELDORET KENYA.
Phone:+254723407705
skype:gmanyali2010



      
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20101201/c20602db/attachment.html>


More information about the users mailing list