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<p class="MsoNormal"><span lang="DE-CH" style="font-size:11.0pt;font-family:"Calibri",sans-serif;color:#1F497D">Hi Joey<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="DE-CH" style="font-size:11.0pt;font-family:"Calibri",sans-serif;color:#1F497D"><o:p> </o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt;font-family:"Calibri",sans-serif;color:#1F497D">Please, provide the full CP2K input file. Otherwise, one can only guess what the problem is.<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt;font-family:"Calibri",sans-serif;color:#1F497D"><o:p> </o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt;font-family:"Calibri",sans-serif;color:#1F497D">Matthias<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt;font-family:"Calibri",sans-serif;color:#1F497D"><o:p> </o:p></span></p>
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<p class="MsoNormal"><b><span lang="DE" style="font-size:11.0pt;font-family:"Calibri",sans-serif">Von:</span></b><span lang="DE" style="font-size:11.0pt;font-family:"Calibri",sans-serif"> 'joey zhang' via cp2k <cp2k@googlegroups.com>
<br>
<b>Gesendet:</b> Freitag, 12. November 2021 09:28<br>
<b>An:</b> cp2k <cp2k@googlegroups.com><br>
<b>Betreff:</b> [CP2K:16216] something wrong with the section_ROOT<o:p></o:p></span></p>
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<p class="MsoNormal"><o:p> </o:p></p>
<p class="MsoNormal">Hi, all<o:p></o:p></p>
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<p class="MsoNormal"> i am new to cp2k, please forgive me for my questions may be a trival.<o:p></o:p></p>
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<p class="MsoNormal">when i submit the AIMD task on the server, it died immediately. The cp2k.out presents that "found an unknown keyword N in section_ROOT_". I guess it might be something wrong with the pseupotential or basis-set of element N. But i did't
find anything wrong. And i also search the section_ROOT in the manual, i found no results. Have you ever met such problem?<o:p></o:p></p>
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<p class="MsoNormal"><img width="882" height="229" style="width:9.1875in;height:2.3854in" id="_x0000_i1025" src="cid:image001.png@01D7D7AD.09018E90" alt="section_ROOT.png"><o:p></o:p></p>
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<p class="MsoNormal"><o:p> </o:p></p>
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<p class="MsoNormal"><img width="407" height="102" style="width:4.2395in;height:1.0625in" id="_x0000_i1026" src="cid:image002.png@01D7D7AD.09018E90" alt="pseupotential.png"><o:p></o:p></p>
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<p class="MsoNormal"><br>
best wishes<o:p></o:p></p>
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<p class="MsoNormal">joey<o:p></o:p></p>
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