[Pw_forum] ERROR IN: iotk_scan_dat_aux and iotk_scan_dat of IOTK LIBRARY?

[sonu kumar]

Dear all QE users,

i am getting errors in iotk while doing following tests:

/tests$ ./check-pw.x.j
Checking atom...passed
Checking atom-lsda...passed
Checking atom-pbe...discrepancy in pressure detected
Reference: -14.44, You got: -14.43
Checking atom-sigmapbe...discrepancy in pressure detected
Reference: -15.02, You got: -15.03
Checking berry...passed
Checking berry, step 2
...########################################################################################################################
# FROM IOTK LIBRARY, VERSION 1.2.0
# UNRECOVERABLE ERROR (ierr=1)
# ERROR IN: iotk_scan_dat_aux (iotk_dat.spp:664)
# CVS Revision: 1.27
# ERROR IN: iotk_scan_dat (iotk_dat.spp:740)
# CVS Revision: 1.27
# Error reading data
name=z.2
rkind=8
rlen=-1
########################################################################################################################
application called MPI_Abort(MPI_COMM_WORLD, 1) - process 0
FAILED with error condition!
Input: berry.in2, Output: berry.out2, Reference: berry.ref2
Aborting


I have this problem with Ubuntu OS, while i have  no problem on
Suse(SLED-11) and
code works nicely there with same make.sys file.

While executing "make all" command i got few warnings from iotk/src, which
are :

mpif90 -O2 -assume byterecl -g -traceback -nomodule -fpp -D__INTEL
-D_SCALAPACK -D__FFTW3 -D__MPI -D__PARA -I../include
-I/extra/sonu/intel/composerxe-2011.0.084/mkl/include/fftw
-I/extra/sonu/mpich2-install/include  -c iotk_base.f90
../include/iotk_config.h(104): warning #5117: Bad # preprocessor line
# 21 "iotk_base.spp" 2
----------------------^
mpif90 -O2 -assume byterecl -g -traceback -nomodule -fpp -D__INTEL
-D_SCALAPACK -D__FFTW3 -D__MPI -D__PARA -I../include
-I/extra/sonu/intel/composerxe-2011.0.084/mkl/include/fftw
-I/extra/sonu/mpich2-install/include  -c iotk_attr_interf.f90
../include/iotk_config.h(104): warning #5117: Bad # preprocessor line
# 21 "iotk_attr_interf.spp" 2
-----------------------------^
mpif90 -O2 -assume byterecl -g -traceback -nomodule -fpp -D__INTEL
-D_SCALAPACK -D__FFTW3 -D__MPI -D__PARA -I../include
-I/extra/sonu/intel/composerxe-2011.0.084/mkl/include/fftw
-I/extra/sonu/mpich2-install/include  -c iotk_error_interf.f90
../include/iotk_config.h(104): warning #5117: Bad # preprocessor line
# 21 "iotk_error_interf.spp" 2
------------------------------^


mpif90 -O2 -assume byterecl -g -traceback -nomodule -fpp -D__INTEL
-D_SCALAPACK -D__FFTW3 -D__MPI -D__PARA -I../include
-I/extra/sonu/intel/composerxe-2011.0.084/mkl/include/fftw
-I/extra/sonu/mpich2-install/include  -c iotk_attr+COMPLEX1_0.f90
iotk_attr.spp(221): remark #8291: Recommended relationship between field
width 'W' and the number of fractional digits 'D' in this edit descriptor is
'W>=D+7'.
    read(string(pos+1:pos1-1),"(G100.95)",iostat=iostat) tmpreal
---------------------------------^


i think something to do with config.h file of iotk.

I shall be thankful for any kind of help.

with regards,
Sonu Kumar

Phd Student
Physics Department
Indian Institute of Technology
Delhi-110016, India
web:-http://www.iitd.ac.in/
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