[Wien] compilation error

[wasim raja Mondal]

Dear gavin
                we want to install wien2k and triqs in one machine. with
mpich I have succesfully installed wien2k but for triqs it needs openmpi.
So i have following questions:

(1) wien2k can be installed with openmpi?

(2)If with openmpi, wien2k is possible to install i have another question
which is following:

      when I am  installing triqs, I am installing openmpi with gfortron
which is the cause of gfortron error in wien2k installtion. I am planning
after instaaling triqs , I will do wien2k installation. For that I have to
compile again openmpi with export f77=ifort? which is command for compiling
openmpi with ifort again? Please help me.


In the triqs manual the first step for triqs installation is

sudo apt-get install cmake git g++ libgfortran3 gfortran openmpi-bin
openmpi-common \
  openmpi-checkpoint libopenmpi-dev libblas-dev liblapack-dev
libfftw3-dev libgmp-dev \
  hdf5-tools libhdf5-serial-dev python-h5py libboost1.48-all-dev python-dev \
  python-numpy python-scipy python-virtualenv python-matplotlib









On Wed, May 8, 2013 at 7:39 PM, Gavin Abo <gsabo at crimson.ua.edu> wrote:

> I can only guess.
>
> 1) You might have more than one mpich version installed on the system, and
> it using the wrong one. If there are other versions, removing them is
> likely the simplest solution.
> 2) You might not have correctly compiled mpich with ifort, and it compiled
> with gfortan instead.
> 3) You might not have specified the correct compiler (mpif90) in
> siteconfig for parallel
>
>
> On 5/8/2013 7:55 AM, wasim raja Mondal wrote:
>
>> Dear Gavin
>> After successful installation of wien2k_12, I am installin it in parallel
>> version in our cluster.
>> I am giving my opt file:
>> root at viper5:/opt# ls
>> intel l_fcompxe_2013.0.079 mpich-3.0.3.tar.gz WIEN2k_12.tar
>> xcrysden_all_debian_and_**ubuntu.tar.gz
>> l_ccompxe_2013.0.079 mpich-3.0.3 wien xcrysden_all_debian_and_ubuntu
>>
>> I am facing the following error:
>>
>> gfortran: error: unrecognized option ‘-prec_div’
>> gfortran: error: unrecognized option ‘-pc80’
>> gfortran: error: unrecognized option ‘-pad’
>> gfortran: error: unrecognized option ‘-traceback’
>> make[1]: *** [modules.o] Error 1
>> make[1]: Leaving directory `/opt/wien/SRC_lapw0'
>> make: *** [para] Error 2
>> Previously also I have faced this error but with export F77=ifort CC=icc
>> CXX=icc FC=ifort during
>> mpich-3.0.3 installation this problem was solved. But this time it is not
>> solving. pleaes help me.
>>
>> Regards
>> wasim
>>
>
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