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<p class="MsoNormal"><span lang="DE-CH" style="font-size:11.0pt;mso-fareast-language:EN-US">Hi Tieyuan<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="DE-CH" style="font-size:11.0pt;mso-fareast-language:EN-US"><o:p> </o:p></span></p>
<p class="MsoNormal"><span lang="EN-US" style="font-size:11.0pt;mso-fareast-language:EN-US">Older versions of CP2K can be installed with the classic Intel compiler and the current CP2K trunk version works with the classic as well as the new oneAPI compilers.
Check the <a href="https://dashboard.cp2k.org/index.html">CP2K dashboard</a> entries
<span class="MsoHyperlink"><a href="https://dashboard.cp2k.org/archive/psi-intel222-psmp/index.html">Linux-intel-x86_64.psmp (22.2)</a></span> and
</span><span style="font-size:11.0pt;mso-fareast-language:EN-US"><a href="https://dashboard.cp2k.org/archive/intel-psmp/index.html">Intel oneAPI (psmp)</a></span><span lang="EN-US" style="font-size:11.0pt;mso-fareast-language:EN-US">.<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US" style="font-size:11.0pt;mso-fareast-language:EN-US">You can try for the current CP2K version 2023.1 the Intel arch file by running the following commands for installation (bash shell):<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US" style="font-size:11.0pt;mso-fareast-language:EN-US"><o:p> </o:p></span></p>
<ul style="margin-top:0cm" type="disc">
<li class="MsoListParagraph" style="margin-left:0cm;mso-list:l0 level1 lfo1"><span style="font-size:11.0pt;font-family:Consolas;mso-fareast-language:EN-US">git clone --recursive -b support/v2023.1 https://github.com/cp2k/cp2k.git cp2k<o:p></o:p></span></li><li class="MsoListParagraph" style="margin-left:0cm;mso-list:l0 level1 lfo1"><span lang="EN-US" style="font-size:11.0pt;font-family:Consolas;mso-fareast-language:EN-US">cd cp2k<o:p></o:p></span></li><li class="MsoListParagraph" style="margin-left:0cm;mso-list:l0 level1 lfo1"><span lang="EN-US" style="font-size:11.0pt;font-family:Consolas;mso-fareast-language:EN-US">source arch/Linux-intel-x86_64.psmp<o:p></o:p></span></li></ul>
<p class="MsoNormal"><span lang="EN-US" style="color:blue;mso-fareast-language:EN-US"><o:p> </o:p></span></p>
<p class="MsoNormal"><span lang="EN-US" style="font-size:11.0pt;mso-fareast-language:EN-US">assuming that the Intel compiler is installed and the corresponding environment and paths are set up properly.<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US" style="font-size:11.0pt;mso-fareast-language:EN-US"><o:p> </o:p></span></p>
<p class="MsoNormal"><span lang="EN-US" style="font-size:11.0pt;mso-fareast-language:EN-US">HTH<br>
<br>
<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US" style="font-size:11.0pt;mso-fareast-language:EN-US">Matthias<o:p></o:p></span></p>
<p class="MsoNormal"><u><span lang="EN-US" style="color:blue;mso-fareast-language:EN-US"><o:p><span style="text-decoration:none"> </span></o:p></span></u></p>
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<b><span style="font-size:12.0pt;color:black">From: </span></b><span style="font-size:12.0pt;color:black">cp2k@googlegroups.com <cp2k@googlegroups.com> on behalf of Tieyuan Bian <biantieyuan@gmail.com><br>
<b>Date: </b>Tuesday, 21 March 2023 at 08:44<br>
<b>To: </b>cp2k <cp2k@googlegroups.com><br>
<b>Subject: </b>[CP2K:18563] installation issue using toolchain<o:p></o:p></span></p>
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<p class="MsoNormal" style="margin-left:36.0pt"><span style="font-size:11.0pt">Dear all,<o:p></o:p></span></p>
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<p class="MsoNormal" style="margin-left:36.0pt"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
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<p class="MsoNormal" style="margin-left:36.0pt"><span style="font-size:11.0pt">I tried to install cp2k-v9.1 on my cluster. However, when I run toolchain, at the stage of installing COSMA, it showed this error :<br>
<img border="0" width="1281" height="104" style="width:13.3437in;height:1.0833in" id="_x0000_i1025" src="cid:26fbc81c-39da-4394-957f-8a3a68887c38"><o:p></o:p></span></p>
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<p class="MsoNormal" style="margin-left:36.0pt"><span style="font-size:11.0pt">I also tried to drag the COSMA.tar.gz into the /install folder but this error still occured. I hope someone could help me.<o:p></o:p></span></p>
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<p class="MsoNormal" style="margin-left:36.0pt"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
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<p class="MsoNormal" style="mso-margin-top-alt:0cm;margin-right:0cm;margin-bottom:12.0pt;margin-left:36.0pt">
<span style="font-size:11.0pt">Besides, my ifort version is 2021.6.0. Does this mean that I cannot install cp2k version of 2022.1 and 2023.1?<o:p></o:p></span></p>
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<p class="MsoNormal" style="margin-left:36.0pt"><span style="font-size:11.0pt">Sincerely,<o:p></o:p></span></p>
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<p class="MsoNormal" style="margin-left:36.0pt"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
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<p class="MsoNormal" style="margin-left:36.0pt"><span style="font-size:11.0pt">Tieyuan BIAN<o:p></o:p></span></p>
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<p class="MsoNormal" style="margin-left:36.0pt"><span style="font-size:11.0pt">--
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