[DFTB-Plus-User] Compiling Error

Benjamin Hourahine benjamin.hourahine at strath.ac.uk
Thu Oct 2 15:30:25 CEST 2008

Hello Gurinder,

this is a bug in the particular version of ifort you are using.
Could you check what that is by using
ifort -v 
and (assuming this is in the standard place) 
ls /opt/intel/fce/
and let me know what that is, as well as supplying more information
about the architecture (intel/amd x86/i686 etc).

Probably just changing to another version of ifort will sort this
out for you.



    Dr. B. Hourahine, Department of Physics, SUPA, University of Strathclyde,
      John Anderson Building, 107 Rottenrow, Glasgow G4 0NG, United Kingdom
    Ph +44 141 548 2325 FAX +44 141 552 2891 benjamin.hourahine at strath.ac.uk

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-----Original Message-----
From: dftb-plus-user-bounces at dftb-plus.info on behalf of gurinder singh
Sent: Thu 02/10/2008 14:08
To: dftb-plus-user at dftb-plus.info
Subject: [DFTB-Plus-User]  Compiling Error
Hello DFTB+ usersI'm a new user and I'm experiencing some problems during compilation of theDFTB+ code.I have all the system requirements needed toinstall this software, however the following error message appears after
some compilation has proceeded:

cpp -traditional -DDEBUG=0 -I/tmp/dftb+_1.0.1_src/prg_dftb/../lib_dftb/ -I
/tmp/dftb+_1.0.1_src/prg_dftb/../includes /tmp/dftb+_1.0.1_src/prg_dftb/../lib_dftb/periodic.F90 |
/tmp/dftb+_1.0.1_src/prg_dftb/../utils/fpp/fpp.sh nocntln > periodic.f90
f90 -O2 -ip -o periodic.o -c periodic.f90
/tmp/dftb+_1.0.1_src/prg_dftb/../lib_dftb/periodic.F90: In function 'unpack2comphs_kpts':
/tmp/dftb+_1.0.1_src/prg_dftb/../lib_dftb/periodic.F90:1455: internal compiler error: in
gfc_conv_array_transpose, at fortran/trans-array.c:750
Please submit a full bug report,
with preprocessed source if appropriate.
See <URL:http://bugzilla.redhat.com/bugzilla> for instructions.
make[1]: *** [periodic.o] Error 1
rm allocate.f90 accuracy.f90 conjgrad.f90 spin.f90 message.f90 bisection.f90 charmanip.f90 sort.f90
linkedlist.f90 periodic.f90 stepdesc.f90 simple_algebra.f90 linmin.f90 lapackroutines.f90 constants.f90
make[1]: Leaving directory `/tmp/dftb+_1.0.1_src/prg_dftb/_obj_i686-linux-ifort'
make: *** [/tmp/dftb+_1.0.1_src/prg_dftb/_obj_i686-linux-ifort] Error 2
Does anyone has some idea how to solve this problem
Thanking You
Dr Gurinder Singh

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