Dear Eitan Please always sign your posts to this forum with your scientific affiliation. As (very) often explained in this forum, this is a gfortran bug. Try to use a recent (i.e > 4.4) version to compile QE. It should fix (almost) all of these iotk troubles. HTH Giuseppe
On Tuesday 18 December 2012 12:18:44 eitan eidelstein wrote: > Hello, > I am using: > Linux admin 2.6.32.12-0.7-default #1 SMP 2010-05-20 11:14:20 +0200 x86_64 > x86_64 x86_64 GNU/Linux > Linux version 2.6.32.12-0.7-default (geeko at buildhost) (gcc version 4.3.4 > [gcc-4_3-branch revision 152973] (SUSE Linux) ) #1 SMP 2010-05-20 11:14:20 > +0200 > SUSE Linux Enterprise Server 11 (x86_64) > VERSION = 11 > PATCHLEVEL = 1 > > downloaded the: > espresso-5.0.2.tar.gz > > compilled with: > Using built-in specs. > Target: x86_64-suse-linux > Configured with: ../configure --prefix=/usr --infodir=/usr/share/info > --mandir=/usr/share/man --libdir=/usr/lib64 --libexecdir=/usr/lib64 > --enable-languages=c,c++,objc,fortran,obj-c++,java,ada > --enable-checking=release --with-gxx-include-dir=/usr/include/c++/4.3 > --enable-ssp --disable-libssp > --with-bugurl=http://bugs.opensuse.org/--with-pkgversion='SUSE Linux' > --disable-libgcj --disable-libmudflap > --with-slibdir=/lib64 --with-system-zlib --enable-__cxa_atexit > --enable-libstdcxx-allocator=new --disable-libstdcxx-pch > --enable-version-specific-runtime-libs --program-suffix=-4.3 > --enable-linux-futex --without-system-libunwind --with-cpu=generic > --build=x86_64-suse-linux > Thread model: posix > gcc version 4.3.4 [gcc-4_3-branch revision 152973] (SUSE Linux) > > configure output:attached > do the next warning is problematic??? > configure: WARNING: using cross tools not prefixed with host triplet > > make all output:attached > > when running example01 in PW/: > eeitan at admin ~/QE/espresso-5.0.2/PW/examples/example01> run_example > > /home/eeitan/QE/espresso-5.0.2/PW/examples/example01 : starting > > This example shows how to use pw.x to calculate the total energy and > the band structure of four simple systems: Si, Al, Cu, Ni. > > executables directory: /home/eeitan/QE/espresso-5.0.2/bin > pseudo directory: /home/eeitan/QE/espresso-5.0.2/pseudo > temporary directory: /home/eeitan/tmp > checking that needed directories and files exist... done > > running pw.x as: /home/eeitan/QE/espresso-5.0.2/bin/pw.x -nband 1 -ntg > 1 > > cleaning /home/eeitan/tmp... done > running the scf calculation for Si... done > running the band-structure calculation for > Si...###################################################################### > ################################################## # FROM IOTK LIBRARY, > VERSION 1.2.0 > # UNRECOVERABLE ERROR (ierr=1) > # ERROR IN: iotk_scan_end (iotk_scan.f90:241) > # CVS Revision: 1.23 > # foundl > # ERROR IN: iotk_close_read (iotk_files.f90:746) > # CVS Revision: 1.20 > ########################################################################### > ############################################# application called > MPI_Abort(MPI_COMM_WORLD, 1) - process 0 > Error condition encountered during test: exit status = 1 > Aborting > > or running example01 in PHonon/: > > eeitan at admin ~/QE/espresso-5.0.2/PHonon/examples/example01> run_example > > /home/eeitan/QE/espresso-5.0.2/PHonon/examples/example01 : starting > > This example shows how to use pw.x and ph.x to calculate phonon > frequencies at Gamma and X for Si and C in the diamond structure and > for fcc-Ni. > > executables directory: /home/eeitan/QE/espresso-5.0.2/bin > pseudo directory: /home/eeitan/QE/espresso-5.0.2/pseudo > temporary directory: /home/eeitan/tmp > > checking that needed directories and files exist... done > > running pw.x as: /home/eeitan/QE/espresso-5.0.2/bin/pw.x -nband 1 -ntg > 1 > running ph.x as: /home/eeitan/QE/espresso-5.0.2/bin/ph.x -nband 1 -ntg > 1 > > cleaning /home/eeitan/tmp... done > running the scf calculation for Si... done > running the phonon calculation at Gamma for > Si...###################################################################### > ################################################## # FROM IOTK LIBRARY, > VERSION 1.2.0 > # UNRECOVERABLE ERROR (ierr=1) > # ERROR IN: iotk_scan_end (iotk_scan.f90:241) > # CVS Revision: 1.23 > # foundl > # ERROR IN: iotk_close_read (iotk_files.f90:746) > # CVS Revision: 1.20 > ########################################################################### > ############################################# application called > MPI_Abort(MPI_COMM_WORLD, 1) - process 0 > done > running the phonon calculation at X for > Si...###################################################################### > ################################################## # FROM IOTK LIBRARY, > VERSION 1.2.0 > # UNRECOVERABLE ERROR (ierr=1) > # ERROR IN: iotk_scan_end (iotk_scan.f90:241) > # CVS Revision: 1.23 > # foundl > # ERROR IN: iotk_close_read (iotk_files.f90:746) > # CVS Revision: 1.20 > ########################################################################### > ############################################# application called > MPI_Abort(MPI_COMM_WORLD, 1) - process 0 > Error condition encountered during test: exit status = 1 > Aborting > > thank in advance, > eitan. -- ******************************************************** - Article premier - Les hommes naissent et demeurent libres et ?gaux en droits. Les distinctions sociales ne peuvent ?tre fond?es que sur l'utilit? commune - Article 2 - Le but de toute association politique est la conservation des droits naturels et imprescriptibles de l'homme. Ces droits sont la libert?, la propri?t?, la s?ret? et la r?sistance ? l'oppression. ******************************************************** Giuseppe Mattioli CNR - ISTITUTO DI STRUTTURA DELLA MATERIA v. Salaria Km 29,300 - C.P. 10 I 00015 - Monterotondo Stazione (RM) Tel + 39 06 90672836 - Fax +39 06 90672316 E-mail: <giuseppe.mattioli at ism.cnr.it>
