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<div style="font-family: Times;"><font face="Calibri,sans-serif">Dear all,</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">I tried to install Molpro 2012.1 PL19 with the command (/…/ replaces the full path in the email):</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">./configure -batch -openmpi -ifort -icc -mpp -mppbase /.../openmpi-1.6.5/include -blaspath /.../intel/composer_xe_2013_sp1.3.174/mkl/lib/intel64 -prefix /…/Molpro</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">on a Linux machine (CentOS 5.8) with Intel compiler. </font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">I have the following error:</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">./configure -batch -openmpi -ifort -icc -mpp -mppbase /.../openmpi-1.6.5/include -blaspath /.../intel/composer_xe_2013_sp1.3.174/mkl/lib/intel64 -prefix /.../Molpro</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">machine type recognized as x86_64 (Generic 64-bit)</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">kernel recognized as Linux</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">user request compiler ifort</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">Intel Fortran Compiler, Version 14.0.3</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">FC=/.../intel/composer_xe_2013_sp1.3.174/bin/intel64/ifort</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">user request compiler icc</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">Intel C compiler, Version 14.0.3</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">CC=/.../intel/composer_xe_2013_sp1.3.174/bin/intel64/icc</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">Use BLAS library - Intel 64-bit Math Kernel Library (MKL) for Linux</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">BLASLIB=-L/.../intel/composer_xe_2013_sp1.3.174/mkl/lib/intel64 -lmkl_intel_ilp64 -lmkl_sequential -lmkl_core</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">MPILIB=-L/.../openmpi-1.6.5/lib -lmpi_f77 -lmpi -ldl -lm -Wl,--export-dynamic -lrt -lnsl -lutil</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">building boost_1_57_0, each step could take a few minutes</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">./bootstrap.sh</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">./tools/build/b2 --prefix=../boost-install link=static toolset=intel --with-system --with-thread install</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">unable to link with parse object using:</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">/.../intel/composer_xe_2013_sp1.3.174/bin/intel64/ifort -i8 -pc64 -auto -vec-report0 -warn nousage -align array32byte -cxxlib -O0 -lpthread /.../Molpro/src/boost-install/lib/libboost_system.a
/.../Molpro/src/boost-install/lib/libboost_thread.a -lrt</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">Please check the compiler is working, flags are correct and all libraries are present</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">failed to determine PARSE</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">Result so far of configure written to CONFIG.errout</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">I have tried with -noboost option without changes. Nothing wrong does not seem to be identified in CONFIG.errout. OpenMPI was compiled withe the same compilers.</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">Have you an idea?</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">Thank you,</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">Best regards,</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif"><br>
</font></div>
<div style="font-family: Times;"><font face="Calibri,sans-serif">Jean-Pierre</font></div>
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