[Wien] (no subject)

[Gavin Abo]

Does the file have read access? 
[http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg07711.html]

Have you tried adding "-I/opt/intel/composer_xe_2013.5.192/mkl/include" 
after $(FOPT) in the Linker Flags? 
[http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg02846.html]

By the way, are you installing Wien2k as 'root' (/root/wien2k/), su, or 
sudo?  I don't recommend that unless you know very well what you are 
doing.  It is recommend to install it as a 'user' (/home/username/wien2k 
or other user partition if home does not have enough hard drive space).

On 4/29/2014 12:43 PM, aboukra at univ-montp2.fr wrote:
> Dear users,
> I tried to compile WIEN2k_13.1 on ssuse13.1,but the following errors 
> appears:
>
> compilation aborted for W2kinit_tmp_.F (code 1)
> make[1]: *** [W2kinit.o] Error 1
> make[1]: Leaving directory `/root/wien2k/SRC_lapw1'
> make: *** [complex] Error 2
> error #5102: Cannot open include file 'mkl_vml.fi
>
> For that I try:
> find /opt/intel -name mkl_vml.fi
> the result is:
> /opt/intel/composer_xe_2013.5.192/mkl/include/mkl_vml.fi
> And:
> opt/intel/composer_xe_2013.5.192/mkl/include/mkl_vml.fi
> the result is:
> bash: /opt/intel/composer_xe_2013.5.192/mkl/include/mkl_vml.fi: 
> Permission denied
>
>
> In addition I give you;
> my .bashrc file:
>
> export PATH=$PATH:/opt/intel/composer_xe_2013.5.192/bin/intel64
> export 
> LD_LIBRARY_PATH=$LD_LIBRARY_PATH:/opt/intel/composer_xe_2013.5.192/mkl/lib/intel64
> export 
> LD_LIBRARY_PATH=$LD_LIBRARY_PATH:/opt/intel/composer_xe_2013.5.192/compiler/lib/intel64
> export INCLUDE=$INCLUDE:/opt/intel/composer_xe_2013.5.192/mkl/include
> INTEL_LICENSE_FILE="/opt/intel/licences"
> export INTEL_LICENSE_FILE
>
> And the compiler options, BLAS and LAPACK:
>
> Compiler options: -FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML 
> -traceback -assume buffered_io
> Linker Flags: $(FOPT) -L$(MKLROOT)/lib/$(MKL_TARGET_ARCH) -pthread
> Preprocessor flags: '-DParallel'
> R_LIB (LAPACK+BLAS): -lmkl_lapack95_lp64 -lmkl_intel_lp64 
> -lmkl_intel_thread -lmkl_core -openmp –lpthread
>
>
> What should I do?
>
> Thank you in advance.
> Best regards,
> A.Boukra
> Institut Charles Gerhardt
> Université Montpellier 2,
> 34095 Montpellier,France