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<p>Dear Gavin</p>
<p>Thank you very much for the detailed istallation descriptions. It
should be very useful for new users.</p>
<p>If you allow, I'll make a link at the installation page to these
2 documents.<br>
</p>
<p><br>
</p>
<p>I've only one comment: You also installed the mpi version of the
code but you did not install ELPA.</p>
<p>Without ELPA the lapw1mpi code is quite slow and thus of limited
use.</p>
<p><br>
</p>
<p>I very much recommend to install ELPA if you want also the mpi
version of the code. Note, that this mpi-compilation is only
useful if you have a cluster with infiniband network or at least a
very powerful multicore workstation (probably min 16 cores). <br>
</p>
<p><br>
</p>
<p>Best regards</p>
<p>Peter Blaha<br>
</p>
<p><br>
</p>
<div class="moz-cite-prefix">Am 28.05.2023 um 20:10 schrieb Gavin
Abo:<br>
</div>
<blockquote type="cite"
cite="mid:676df189-428c-6bbb-4b4b-0011c9df4b6c@gmail.com">
<meta http-equiv="Content-Type" content="text/html; charset=UTF-8">
<p>I was able to compile and link without any build errors a fresh
install of WIEN2k 23.2 using gfortran 11.3.0 in Ubuntu 22.04.2
LTS today. Should it be of interest to anyone installing the
23.2 version of WIEN2k, the PDF in which I recorded the steps
should be at:<br>
</p>
<p><br>
</p>
<p><a class="moz-txt-link-freetext"
href="https://github.com/gsabo/WIEN2k-Docs/blob/main/WIEN2k23.2_Ubuntu22.04_Install_with_gfortran.pdf"
moz-do-not-send="true">https://github.com/gsabo/WIEN2k-Docs/blob/main/WIEN2k23.2_Ubuntu22.04_Install_with_gfortran.pdf</a><br>
</p>
<p><br>
</p>
<p>Kind Regards,</p>
<p>Gavin</p>
<p>WIEN2k user<br>
</p>
<p><br>
</p>
<div class="moz-cite-prefix">On 5/28/2023 9:57 AM, Ilias Miroslav,
doc. RNDr., PhD. wrote:<br>
</div>
<blockquote type="cite"
cite="mid:VI1PR0702MB356623C509368410E795899BF7459@VI1PR0702MB3566.eurprd07.prod.outlook.com">
<meta http-equiv="Content-Type" content="text/html;
charset=UTF-8">
<style type="text/css" style="display:none;">P {margin-top:0;margin-bottom:0;}</style>
<div style="font-family: Calibri, Arial, Helvetica, sans-serif;
font-size: 12pt; color: rgb(0, 0, 0); background-color:
rgb(255, 255, 255);" class="elementToProof"> Hello,</div>
<div style="font-family: Calibri, Arial, Helvetica, sans-serif;
font-size: 12pt; color: rgb(0, 0, 0); background-color:
rgb(255, 255, 255);" class="elementToProof"> <br>
</div>
<div style="font-family: Calibri, Arial, Helvetica, sans-serif;
font-size: 12pt; color: rgb(0, 0, 0); background-color:
rgb(255, 255, 255);" class="elementToProof"> after lenghty
compilation of Wien2k the linking step crashed. It there a
quick way just to fix the linking command and relink the code
for getting final executables ?</div>
<div style="font-family: Calibri, Arial, Helvetica, sans-serif;
font-size: 12pt; color: rgb(0, 0, 0); background-color:
rgb(255, 255, 255);" class="elementToProof"> <br>
</div>
<div style="font-family: Calibri, Arial, Helvetica, sans-serif;
font-size: 12pt; color: rgb(0, 0, 0); background-color:
rgb(255, 255, 255);" class="elementToProof"> Wien2k setup
offers only recompilation of the whole bunch, without checking
if files were previously compiled.</div>
<div style="font-family: Calibri, Arial, Helvetica, sans-serif;
font-size: 12pt; color: rgb(0, 0, 0); background-color:
rgb(255, 255, 255);" class="elementToProof"> <br>
</div>
<div style="font-family: Calibri, Arial, Helvetica, sans-serif;
font-size: 12pt; color: rgb(0, 0, 0); background-color:
rgb(255, 255, 255);" class="elementToProof"> Best, Miro<br>
</div>
</blockquote>
<br>
<fieldset class="moz-mime-attachment-header"></fieldset>
<pre class="moz-quote-pre" wrap="">_______________________________________________
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</pre>
</blockquote>
<pre class="moz-signature" cols="72">--
-----------------------------------------------------------------------
Peter Blaha, Inst. f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-158801165300
Email: <a class="moz-txt-link-abbreviated" href="mailto:peter.blaha@tuwien.ac.at">peter.blaha@tuwien.ac.at</a>
WWW: <a class="moz-txt-link-freetext" href="http://www.imc.tuwien.ac.at">http://www.imc.tuwien.ac.at</a> WIEN2k: <a class="moz-txt-link-freetext" href="http://www.wien2k.at">http://www.wien2k.at</a>
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