<html><head><meta http-equiv="Content-Type" content="text/html charset=windows-1252"></head><body style="word-wrap: break-word; -webkit-nbsp-mode: space; -webkit-line-break: after-white-space;"><div><br></div><div>I do not think that there is a mistake in the flags. See what I have in the OPTIONS file:</div><div><div>current:FOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback -assume buffered_io</div><div>current:FPOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback -assume buffered_io</div><div>current:FFTW_OPT:-DFFTW3 -I/opt/software/libraries/fftw3/3.3.4/include</div><div>current:FFTW_LIBS:-lfftw3_mpi -lfftw3 -L/opt/software/libraries/fftw3/3.3.4/lib</div><div>current:LDFLAGS:$(FOPT) -L/opt/software/intel/composer_xe_2015.0.090/mkl/lib/intel64 -pthread</div><div>current:DPARALLEL:'-DParallel'</div><div>current:R_LIBS:-lmkl_lapack95_lp64 -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -openmp -lpthread</div><div>current:RP_LIBS:-lmkl_scalapack_lp64 -lmkl_blacs_lp64 $(R_LIBS)</div><div>current:MPIRUN:mpirun -np _NP_ -machinefile _HOSTS_ _EXEC_</div><div>current:MKL_TARGET_ARCH:intel64</div></div><div><br></div><div>BTW, I also had to give the full path to mkl: the MKLROOT variable did not work. We have intel 15.0.090 installed. </div><div><br></div><div>The libraries/compilers have not been installed by myself, nor by root, but by a system manager (supercomputing center). I am just using what is installed to compile my own version of wien2k. The mkl_vml* files are readable (but not writable) by anyone using the supercomputer.</div><div>So, maybe your option b) is the correct one.</div><div><br></div><div>Pascal</div><div><br></div><br><div><div>Le 26 mars 2015 à 16:11, Gavin Abo <<a href="mailto:gsabo@crimson.ua.edu">gsabo@crimson.ua.edu</a>> a écrit :</div><br class="Apple-interchange-newline"><blockquote type="cite">
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<div class="moz-cite-prefix">Good, that means that the file
mkl_vml.fi exists and can be opened. However, I don't know why
you still have the error that it cannot open the file, when it can
be opened.<br>
<br>
The only things I can currently think of that could cause that
are:<br>
<br>
a) When you added the -I line in siteconfig to the Linker Flags,
maybe the change was not saved or a typo was made in entering the
include location.<br>
<br>
b) A switch between accounts might be happening in the terminal,
where the accounts do not have the same file permissions. For
example, if the head command was ran as root, but then siteconfig
was ran as a user.<br>
<br>
On 3/26/2015 6:27 AM, farouk boutaiba wrote:<br>
</div>
<blockquote cite="mid:2019445957.2899806.1427372836494.JavaMail.yahoo@mail.yahoo.com" type="cite">
<div style="background-color: rgb(255, 255, 255); font-family: 'times new roman', 'new york', times, serif; font-size: 16px;">
<div dir="ltr" id="yui_3_16_0_1_1427372654489_4296"><span id="yui_3_16_0_1_1427372654489_4295">I have this message:</span></div>
<div dir="ltr" id="yui_3_16_0_1_1427372654489_4298"><span id="yui_3_16_0_1_1427372654489_4297">! file: mkl_vmf.fi</span></div>
<div dir="ltr" id="yui_3_16_0_1_1427372654489_4300"><span id="yui_3_16_0_1_1427372654489_4299">thank you for your
help.</span></div>
<div dir="ltr" id="yui_3_16_0_1_1427372654489_4303"><span><br>
</span></div>
<div id="yui_3_16_0_1_1427372654489_4304"> </div>
<div id="yui_3_16_0_1_1427372654489_4306">
<div id="yui_3_16_0_1_1427372654489_4305" dir="ltr">BOUTAIBA
Farouk</div>
<div id="yui_3_16_0_1_1427372654489_4305" dir="ltr">Department
of Physics</div>
<div id="yui_3_16_0_1_1427372654489_4305" dir="ltr">Faculty of
Science</div>
<div id="yui_3_16_0_1_1427372654489_4305" dir="ltr">University
of Science and Technology of Oran</div>
<div id="yui_3_16_0_1_1427372654489_4305" dir="ltr">P.O.Box:
1505 El M'Naouer</div>
<div id="yui_3_16_0_1_1427372654489_4305" dir="ltr">31000 Oran</div>
<div id="yui_3_16_0_1_1427372654489_4305" dir="ltr">Algeria</div>
<div id="yui_3_16_0_1_1427372654489_4305" dir="ltr"><br>
</div>
</div>
<br>
<div class="qtdSeparateBR"><br>
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serif; font-size: 16px;">
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<div dir="ltr"> <font face="Arial" size="2"> Le Mercredi
25 mars 2015 19h01, farouk boutaiba
<a class="moz-txt-link-rfc2396E" href="mailto:boutaiba_f@yahoo.fr"><boutaiba_f@yahoo.fr></a> a écrit :<br>
</font> </div>
<br>
<br>
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<div style="background-color: rgb(255, 255, 255); font-family: 'times new roman', 'new york', times, serif; font-size: 16px;">
<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_125601" style="">I have change -L to -I <span class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_125869" style="color:rgb(33, 33, 33);font-family:inherit;font-weight:lighter;line-height:36px;"><font size="3">as you told me</font></span> </pre>
<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_125601" style="">"-I/opt/intel/composer_xe_2013.0.079/mkl/include" </pre>
<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_125601" style="">after $(FOPT) in the Linker Flags, but after compilation i have the same message error.</pre>
<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_125601" style="">thank you sir</pre>
<div id="yiv7953976108yui_3_16_0_1_1426893879680_125602">
<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116900" style=""><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_125639" style=""> BOUTAIBA Farouk
</i><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116957" style=""> Department of Physics
</i><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_125636" style=""> Faculty of Science
</i><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116928" style=""> University of Science and Technology of Oran
</i><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116911" style=""> P.O.Box: 1505 El M'Naouer
</i><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116899" style=""> 31000 Oran </i><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_125618" style="">Algeria</i><span class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116924" style="font-family:'times new roman', 'new york', times, serif;"> </span></pre>
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<div class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_125602" style=""><br class="yiv7953976108" style="" clear="none">
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<div class="yiv7953976108yqt3808653260" id="yiv7953976108yqt98199">
<div class="yiv7953976108yahoo_quoted" style="display: block;">
<div style="font-family:times new roman, new
york, times, serif;font-size:16px;">
<div style="font-family:HelveticaNeue,
Helvetica Neue, Helvetica, Arial, Lucida
Grande, sans-serif;font-size:16px;">
<div dir="ltr"> <font face="Arial" size="2"> Le Mercredi 25 mars 2015
14h43, farouk boutaiba
<a class="moz-txt-link-rfc2396E" href="mailto:boutaiba_f@yahoo.fr"><boutaiba_f@yahoo.fr></a> a écrit :<br clear="none">
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<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116851" style="">I have used wien2k 2014, but diring compilation a got these message:</pre>
<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116851" style="">compilation aborted for W2kinit_tmp.F (code 1)
make[1]: *** [W2kinit.o] Erreur 1
make[1] : on quitte le répertoire « /root/wien2k_14/SRC_vecpratt »
make: *** [real] Erreur 2
</pre>
<div class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116992" style=""><br class="yiv7953976108" style="" clear="none">
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<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116851" style="">and after compilation i have this message:</pre>
<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116851" style="">Compile time errors (if any) were:
SRC_hf/compile.msg:W2kinit_tmp_.F(28): error #5102: Cannot open include file 'mkl_vml.fi'
SRC_hf/compile.msg:W2kinit_tmp_.F(28): error #5102: Cannot open include file 'mkl_vml.fi'
SRC_lapw0/compile.msg:W2kinit.F(28): error #5102: Cannot open include file 'mkl_vml.fi'
SRC_lapw1/compile.msg:W2kinit_tmp_.F(28): error #5102: Cannot open include file 'mkl_vml.fi'
SRC_lapw1/compile.msg:W2kinit_tmp_.F(28): error #5102: Cannot open include file 'mkl_vml.fi'
SRC_lapw2/compile.msg:W2kinit_tmp_.F(28): error #5102: Cannot open include file 'mkl_vml.fi'
SRC_lapw2/compile.msg:W2kinit_tmp_.F(28): error #5102: Cannot open include file 'mkl_vml.fi'
SRC_mixer/compile.msg:W2kinit.F(28): error #5102: Cannot open include file 'mkl_vml.fi'
SRC_vecpratt/compile.msg:W2kinit_tmp.F(28): error #5102: Cannot open include file 'mkl_vml.fi'
SRC_vecpratt/compile.msg:W2kinit_tmp.F(28): error #5102: Cannot open include file 'mkl_vml.fi' </pre>
<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116851" style="">Thank for your help
</pre>
<div class="yiv7953976108" dir="ltr" id="yiv7953976108yui_3_16_0_1_1426893879680_116974" style=""><br clear="none">
</div>
<pre class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116900" style=""><i class="yiv7953976108" style=""> BOUTAIBA Farouk
</i><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116957" style=""> Department of Physics
</i><i class="yiv7953976108" style=""> Faculty of Science
</i><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116928" style=""> University of Science and Technology of Oran
</i><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116911" style=""> P.O.Box: 1505 El M'Naouer
</i><i class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116899" style=""> 31000 Oran </i><i class="yiv7953976108" style="">Algeria</i><span class="yiv7953976108" id="yiv7953976108yui_3_16_0_1_1426893879680_116924" style="font-family:'times new roman', 'new york', times, serif;">
</span></pre>
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