My Community

Dear all,
I am trying to calculate the PROCAR file with LSORBIT=TRUE included and the following INCAR

SYSTEM=LiAgSe

ISTART = 1
ICHARG = 11
LSORBIT = .TRUE.
LORBIT = 12
LMAXMIX = 4
ISYM = 0
PREC = h
ISMEAR = 0
SIGMA = 0.01
ISIF = 2
#NBANDS = 40
ENCUT = 400
NPAR = 6
IALGO = 38
IBRION = -1
########################## Relaxation ########################
NELMIN = 5
EDIFF = 1E-04
EDIFFG = -0.001
NSW = 0
MAXMIN = 80

And I get the following segmentation fault.

forrtl: severe (174): SIGSEGV, segmentation fault occurred
Image PC Routine Line Source
vasp 000000000087A8F7 Unknown Unknown Unknown
vasp 00000000004D4B12 Unknown Unknown Unknown
vasp 000000000049D9DC Unknown Unknown Unknown
libc.so.6 00002B5ED70A5CDD Unknown Unknown Unknown
vasp 000000000049D8D9 Unknown Unknown Unknown
--------------------------------------------------------------------------
mpirun has exited due to process rank 1 with PID 11308 on
node node184.cruncher exiting without calling "finalize". This may
have caused other processes in the application to be
terminated by signals sent by mpirun (as reported here).
--------------------------------------------------------------------------

Any idea?

Check your stack size limit (line
ulimit -s unlimited
in the .bashrc file)