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<p class="MsoNormal"><span style="mso-ansi-language:EN-US">Dear all <br></span></p>
<p class="MsoNormal"><span style="mso-ansi-language:EN-US">I am a new
user of Wien2k. I installed and used the code in serial, and once I gained
experience, I decided to install the parallel version on my cluster. I have an
AMD based system with</span></p>
<p class="MsoNormal"><span style="mso-ansi-language:EN-US">a) intel
ifort compiler 11.0,</span></p>
<p class="MsoNormal"><span style="mso-ansi-language:EN-US">b) mkl 10.3
libraries (I patched this libraries as described at the web site :<a href="http://software.intel.com/en-us/forums/showthread.php?t=102749" target="_blank">http://software.intel.com/en-us/forums/showthread.php?t=102749</a>)</span></p>
<p class="MsoNormal"><span style="mso-ansi-language:EN-US">c)
OPENMPI-1.4.3<span style="mso-spacerun:yes"> </span></span></p>
<p class="MsoNormal"><span style="mso-ansi-language:EN-US">Although<span style="mso-spacerun:yes"> </span>the installation did not give any errors,
when I run the script runsp_lapw in parallel mode using the switch <span style="mso-spacerun:yes"> </span>-p, I get the error message : <br></span></p>
<p class="MsoNormal"><span style="mso-ansi-language:EN-US">/globalgfs/WIEN2K/lapw1_mpi:
symbol lookup error:
/opt/intel/Compiler/11.0/081/mkl/lib/em64t/libmkl_scalapack_lp64.so: undefined
symbol:MKL_INT<br>
/globalgfs/WIEN2K/lapw1_mpi: symbol lookup error:
/opt/intel/Compiler/11.0/081/mkl/lib/em64t/libmkl_scalapack_lp64.so: undefined
symbol: MKL_INT<br>
/globalgfs/WIEN2K/lapw1_mpi: symbol lookup error:
/opt/intel/Compiler/11.0/081/mkl/lib/em64t/libmkl_scalapack_lp64.so: undefined
symbol: MKL_INT<br>
/globalgfs/WIEN2K/lapw1_mpi: symbol lookup error:
/opt/intel/Compiler/11.0/081/mkl/lib/em64t/libmkl_scalapack_lp64.so: undefined
symbol: MKL_INT</span></p>
<p class="MsoNormal"><span style="mso-ansi-language:EN-US">The problem
is that the mkl_scalapack library that I used to compile the code has a
different path. In fact the output of the ldd command is <br></span></p>
<p class="MsoNormal"><span style="mso-ansi-language:EN-US">ldd
/globalgfs/WIEN2K/lapw1_mpi </span></p>
<p class="MsoNormal"><span style="mso-ansi-language:EN-US">libmkl_scalapack_lp64.so
=> /opt/intel/mkl/lib/intel64/libmkl_scalapack_lp64.so
(0x00002b5cdb250000)………………......</span></p>
<p class="MsoNormal"><span style="">Am I
missing something or am I doing anything wrong? <br></span></p><p class="MsoNormal"><span style="mso-ansi-language:EN-US">Please let
me know if you need more information.</span></p>
<p class="MsoNormal"><span style="mso-ansi-language:EN-US">Bests </span></p>
<p class="MsoNormal"><span style="">Luca
Sementa.</span></p><p class="MsoNormal">IPCF-CNR Pisa (Italy)<br></p><p class="MsoNormal"><br><span style=""></span></p><p class="MsoNormal"><span style="mso-ansi-language:EN-US"><br></span></p>
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