<div dir="ltr"><div><div><div><div><div>Dear gavin<br></div> 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:<br>
<br></div>(1) wien2k can be installed with openmpi?<br><br></div>(2)If with openmpi, wien2k is possible to install i have another question which is following:<br></div> <br></div> 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.<br>
<div><br><br>In the triqs manual the first step for triqs installation is <br><pre>sudo apt-get install cmake git g++ libgfortran3 gfortran openmpi-bin openmpi-common <span class="">\</span>
openmpi-checkpoint libopenmpi-dev libblas-dev liblapack-dev libfftw3-dev libgmp-dev <span class="">\</span>
hdf5-tools libhdf5-serial-dev python-h5py libboost1.48-all-dev python-dev <span class="">\</span>
python-numpy python-scipy python-virtualenv python-matplotlib<br><br><br><br><br></pre><pre><br></pre><br><div><div><div><br></div></div></div></div></div><div class="gmail_extra"><br><br><div class="gmail_quote">On Wed, May 8, 2013 at 7:39 PM, Gavin Abo <span dir="ltr"><<a href="mailto:gsabo@crimson.ua.edu" target="_blank">gsabo@crimson.ua.edu</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">I can only guess.<br>
<br>
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.<br>
2) You might not have correctly compiled mpich with ifort, and it compiled with gfortan instead.<br>
3) You might not have specified the correct compiler (mpif90) in siteconfig for parallel<div><div class="h5"><br>
<br>
On 5/8/2013 7:55 AM, wasim raja Mondal wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
Dear Gavin<br>
After successful installation of wien2k_12, I am installin it in parallel version in our cluster.<br>
I am giving my opt file:<br>
root@viper5:/opt# ls<br>
intel l_fcompxe_2013.0.079 mpich-3.0.3.tar.gz WIEN2k_12.tar xcrysden_all_debian_and_<u></u>ubuntu.tar.gz<br>
l_ccompxe_2013.0.079 mpich-3.0.3 wien xcrysden_all_debian_and_ubuntu<br>
<br>
I am facing the following error:<br>
<br>
gfortran: error: unrecognized option ‘-prec_div’<br>
gfortran: error: unrecognized option ‘-pc80’<br>
gfortran: error: unrecognized option ‘-pad’<br>
gfortran: error: unrecognized option ‘-traceback’<br>
make[1]: *** [modules.o] Error 1<br>
make[1]: Leaving directory `/opt/wien/SRC_lapw0'<br>
make: *** [para] Error 2<br>
Previously also I have faced this error but with export F77=ifort CC=icc CXX=icc FC=ifort during<br>
mpich-3.0.3 installation this problem was solved. But this time it is not solving. pleaes help me.<br>
<br>
Regards<br>
wasim<br>
</blockquote>
<br></div></div>
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