[Wien] Error while running 11.1

Vit vitruss at gmail.com
Fri Apr 8 05:06:01 CEST 2011


Dear Dr. Blaha and Wien2k users!
I'm getting this error when trying to run parallel calculations of
sample TiC. V11.1 compiled with gfortran, ACML and fftw 2.1.5:

At line 1877 of file lapw0.F (unit = 21, file = 'TiC.scf0')
Fortran runtime error: Expected INTEGER for item 4 in formatted
transfer, got REAL
USE=',i3,' SIGMA OF V-XC FIT FOR ATOM',i3,e15.7)
                                      ^
--------------------------------------------------------------------------
mpirun has exited due to process rank 0 with PID 23411 on
node thunder exiting without calling "finalize". This may
have caused other processes in the application to be
terminated by signals sent by mpirun (as reported here).
--------------------------------------------------------------------------

The  same is produced with nit parallel run.
With best regards,
VIctor.


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