<br><font size="4">I am installing MPICH2 manually now, it appears another error. I did </font><br><br>lzhang200@lzhang200:~/mpich2-1.5$ which ifort<br>/opt/intel/composer_xe_2013.2.146/bin/intel64/ifort<br>lzhang200@lzhang200:~/mpich2-1.5$ <br>
lzhang200@lzhang200:~/mpich2-1.5$ export FC=ifort<br>lzhang200@lzhang200:~/mpich2-1.5$ export F77=ifort<br>lzhang200@lzhang200:~/mpich2-1.5$ <br>lzhang200@lzhang200:~/mpich2-1.5$ ./configure --prefix=/opt/mpich2_1.5<br><br>
<font size="4">But it says </font><br><br>....<br>checking for ifort... no<br>....<br>configure: error: No Fortran 77 compiler found. <br><font size="4"><br>Why it does not use ifort as Fortran 77 compiler ? </font><br><font size="4">I guess I missed some basic practice after installing Intel ifort, or it's not installed properly at all ... but it went through smoothly I didn't see any error. </font><br>
<br><font size="4">Thank you. </font><br><font size="4"><br>Long</font><br><br><div class="gmail_quote">On Fri, Feb 22, 2013 at 1:26 AM, 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">
<div text="#000000" bgcolor="#FFFFFF">
<div><font size="4">MPICH2 v<font size="4">ia
</font></font><font size="4">Ubuntu Software Center i<font size="4">s <font size="4"><font size="4">probably</font>
compiled with gfortran<br>
<br>
<font size="4"><font size="4"><font size="4"><font size="4">The
following command in a terminal mig<font size="4">ht
tell you w<font size="4">hat <font size="4">compiler
was used<font size="4"> to make </font></font></font></font></font></font></font></font></font></font></font><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4">MPICH2</font>:<br>
<br>
<font size="4">mpif90 -v<br>
</font></font></font></font></font></font></font></font></font><br>
<font size="4"><font size="4">Mo<font size="4">st likely <font size="4">you <font size="4">should get <font size="4">a source package from<font size="4">:<br>
<br>
<font size="4"><a href="http://www.mpich.org/downloads/" target="_blank">http://www.mpich.org/downloads/</a></font><br>
</font></font></font></font></font></font></font><br>
<font size="4">Then, <font size="4">compile it with ifort
(.<font size="4">/</font>configure, make</font></font>,
an<font size="4">d <font size="4">make install<font size="4">)</font>.<br>
<br>
</font></font></font></font></font><font size="4">FFTW3
via Ubuntu Software Center<font size="4"> can work<font size="4">
for serial, but </font>the <font size="4">development <font size="4">package may not have the libfftw<font size="4">3_mpi.a
package needed<font size="4"> for mpi.<br>
<br>
<font size="4">Most like<font size="4">ly you shoul<font size="4">d get and compile th<font size="4">e
source package from:<br>
<br>
</font></font></font></font></font><a href="http://www.fftw.org/download.html" target="_blank">http://www.fftw.org/download.html</a></font></font></font></font><br>
<br>
</font><div><div class="h5">On 2/21/2013 10:20 PM, Long Zhang wrote:<br>
</div></div></div><div><div class="h5">
<blockquote type="cite"><br>
<font size="4">Hello, <br>
<br>
I am trying to install the current version 12.1 on Ubuntu 12.04
(64-bit). I met some problem related to mpi, can someone please
give me some hint<font size="4">?</font> Thanks in advance. <br>
<br>
The situation is like this, on a freshly installed Ubuntu 12.04
64bit, I installed current version Intel Fortran Composer XE
2013.2.146, and installed MPICH2 and FFTW3 via Ubuntu Software
Center. <br>
<br>
Before run the siteconfig_lapw, I checked <br>
<font>which ifort<br>
/opt/intel/composer_xe_2013.2.146/bin/intel64/ifort<br>
which mpif90<br>
/usr/bin/mpif90</font><br>
<br>
and did the following 3 lines in the terminal<br>
<font>source
/opt/intel/composer_xe_2013.2.146/bin/compilervars.sh intel64<br>
export
LD_LIBRARY_PATH=$LD_LIBRARY_PATH:/opt/intel/composer_xe_2013.2.146/mkl/lib/intel64<br>
export MKLROOT=/opt/intel/composer_xe_2013.2.146/mkl/</font><br>
<br>
Then I run the siteconfig_lapw, and selected system as
"ifort12+mkl" (the first one), selected compilers as "ifort" and
"cc", selected "finegrained parallel" and "mpif90", and got
error message like this: <br>
</font><br>
----------------------------------------------- cut1
-----------------------------------------------<br>
Compile time errors (if any) were:<br>
SRC_hf/compile.msg:make[1]: *** [modules.o] Error 1<br>
SRC_hf/compile.msg:make: *** [rp] Error 2<br>
SRC_hf/compile.msg:make[1]: *** [modules.o] Error 1<br>
SRC_hf/compile.msg:make: *** [cp] Error 2<br>
SRC_lapw0/compile.msg:make[1]: *** [modules.o] Error 1<br>
SRC_lapw0/compile.msg:make: *** [para] Error 2<br>
SRC_lapw1/compile.msg:make[1]: *** [modules.o] Error 1<br>
SRC_lapw1/compile.msg:make: *** [rp] Error 2<br>
SRC_lapw1/compile.msg:make[1]: *** [modules.o] Error 1<br>
SRC_lapw1/compile.msg:make: *** [cp] Error 2<br>
SRC_lapw2/compile.msg:make[1]: *** [modules.o] Error 1<br>
SRC_lapw2/compile.msg:make: *** [rp] Error 2<br>
SRC_lapw2/compile.msg:make[1]: *** [modules.o] Error 1<br>
SRC_lapw2/compile.msg:make: *** [cp] Error 2<br>
----------------------------------------------- cut1
-----------------------------------------------<br>
<br>
<font size="4">I looked into SRC_lapw1/compile.msg, and the
detailed error is: </font><br>
<br>
----------------------------------------------- cut2
-----------------------------------------------<br>
mpif90 -FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -DFFTW3
-traceback -DParallel -c modules_tmp_.F<br>
--------------------------------------------------------------------------<br>
The Open MPI wrapper compiler was unable to find the specified
compiler<br>
gfortran in your PATH.<br>
<br>
Note that this compiler was either specified at configure time or
in<br>
one of several possible environment variables.<br>
--------------------------------------------------------------------------<br>
make[1]: *** [modules.o] Error 1<br>
make[1]: Leaving directory `/home/lzhang200/wien2k/SRC_lapw1'<br>
make: *** [rp] Error 2<br>
----------------------------------------------- cut2
-----------------------------------------------<br>
<font size="4"><br>
It seems OpenMPI was invoked and it looked for gfortran<font size="4">. </font>I don't have gfortran installed at all<font size="4">, but I found I have openmpi installed.</font> I then
<font size="4">used U<font size="4">buntu Softw<font size="4">are
Center to search <font size="4">op<font size="4">enmpi
and un<font size="4">installed related packages. I
restarted the system and repeated the
siteconfig_lapw. <br>
<font size="4">However I still get error message<font size="4">, not same but simil<font size="4">ar,
it still looks for gfortran, for example<font size="4"> the </font></font></font></font></font></font></font></font></font></font></font><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4"><font size="4">SRC_lapw1/compile.msg
shows:</font></font><br>
<br>
</font></font></font></font></font></font></font></font></font>-----------------------------------------------
cut3 -----------------------------------------------<br>
mpif90 -FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -DFFTW3
-traceback -DParallel -c modules_tmp_.F<br>
/usr/bin/mpif90: line 370: gfortran: command not found<br>
make[1]: *** [modules.o] Error 127<br>
make[1]: Leaving directory `/home/lzhang200/wien2k/SRC_lapw1'<br>
make: *** [rp] Error 2<br>
----------------------------------------------- cut3
-----------------------------------------------<br>
<br>
<font size="4">I did not specify to use gfortran anywhere in the
setup<font size="4"> of siteconfig_lapw, </font>I <font size="4">don't</font> <font size="4">see</font> <font size="4">why <font size="4">mpif90</font> keeps looking for
it. <font size="4">How <font size="4">can I <font size="4">fix
this problem<font size="4">? Thank<font size="4">s a
lot. <br>
<br>
<font size="4">Regards,<br>
<font size="4">Long Zhang</font><br>
</font></font></font></font></font></font></font></font></blockquote>
<br>
</div></div></div>
<br>_______________________________________________<br>
Wien mailing list<br>
<a href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a><br>
<a href="http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien" target="_blank">http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien</a><br>
<br></blockquote></div><br>