<div dir="ltr">Hi Matthias,<div>Ok. Thank you.</div><div><br></div><div>Best reegards,</div><div>Chaimaa.</div><div><br></div></div><div dir="ltr"></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">Le mer. 13 mars 2019 à 09:10, Krack Matthias (PSI) <<a href="mailto:matthia...@psi.ch" target="_blank">matthia...@psi.ch</a>> a écrit :<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"> <div lang="EN-US"> <div class="gmail-m_5699195631351126702gmail-m_-2496769335014472954WordSection1"> <p class="MsoNormal"><span lang="EN-GB" style="font-size:11pt;font-family:Calibri,sans-serif;color:rgb(31,73,125)">Hi Chaimaa<u></u><u></u></span></p> <p class="MsoNormal"><span lang="EN-GB" style="font-size:11pt;font-family:Calibri,sans-serif;color:rgb(31,73,125)"><u></u> <u></u></span></p> <p class="MsoNormal"><span lang="EN-GB" style="font-size:11pt;font-family:Calibri,sans-serif;color:rgb(31,73,125)">Just check the online manual for the input section cell: <a href="https://manual.cp2k.org/trunk/CP2K_INPUT/FORCE_EVAL/SUBSYS/CELL.html" target="_blank">https://manual.cp2k.org/trunk/CP2K_INPUT/FORCE_EVAL/SUBSYS/CELL.html</a> <u></u><u></u></span></p> <p class="MsoNormal"><span lang="EN-GB" style="font-size:11pt;font-family:Calibri,sans-serif;color:rgb(31,73,125)"><u></u> <u></u></span></p> <p class="MsoNormal"><span lang="EN-GB" style="font-size:11pt;font-family:Calibri,sans-serif;color:rgb(31,73,125)">Matthias<u></u><u></u></span></p> <p class="MsoNormal"><span lang="EN-GB" style="font-size:11pt;font-family:Calibri,sans-serif;color:rgb(31,73,125)"><u></u> <u></u></span></p> <p class="MsoNormal"><b><span style="font-size:11pt;font-family:Calibri,sans-serif">From:</span></b><span style="font-size:11pt;font-family:Calibri,sans-serif"> <a href="mailto:cp...@googlegroups.com" target="_blank">cp...@googlegroups.com</a> <<a href="mailto:cp...@googlegroups.com" target="_blank">cp...@googlegroups.com</a>> <b>On Behalf Of </b>chaimaa Dahri<br> <b>Sent:</b> Mittwoch, 13. März 2019 08:44<br> <b>To:</b> <a href="mailto:cp...@googlegroups.com" target="_blank">cp...@googlegroups.com</a><br> <b>Subject:</b> Re: [CP2K:11408] Re: ERROR: Program received signal SIGABRT: Process abort signal<u></u><u></u></span></p> <p class="MsoNormal"><u></u> <u></u></p> <div> <p class="MsoNormal">Hi Matthias,<u></u><u></u></p> <div> <p class="MsoNormal"><u></u> <u></u></p> <div> <p class="MsoNormal">Could you explain more please? <u></u><u></u></p> </div> <div> <p class="MsoNormal">I'm new at CP2K and i couldn't get what you said.<u></u><u></u></p> </div> <div> <p class="MsoNormal">Thank you,<u></u><u></u></p> </div> <div> <p class="MsoNormal"><u></u> <u></u></p> </div> <div> <p class="MsoNormal">Chaimaa.<u></u><u></u></p> </div> </div> </div> <p class="MsoNormal"><u></u> <u></u></p> <div> <div> <p class="MsoNormal">Le dim. 10 mars 2019 à 10:36, Matthias Krack <<a href="mailto:matthia...@psi.ch" target="_blank">matthia...@psi.ch</a>> a écrit :<u></u><u></u></p> </div> <blockquote style="border-top:none;border-right:none;border-bottom:none;border-left:1pt solid rgb(204,204,204);padding:0cm 0cm 0cm 6pt;margin-left:4.8pt;margin-right:0cm"> <div> <div> <p class="MsoNormal">Hi Chaimaa<u></u><u></u></p> </div> <div> <p class="MsoNormal"><u></u> <u></u></p> </div> <div> <p class="MsoNormal">the CELL section contains the invalid keywords ALPHA, BETA, and GAMMA. You should either specify a proper set of cell vectors A, B, and C or use the keword ABC in combination with the keyword ALPHA_BETA_GAMMA.<u></u><u></u></p> </div> <div> <p class="MsoNormal"><u></u> <u></u></p> </div> <div> <p class="MsoNormal">HTH<u></u><u></u></p> </div> <div> <p class="MsoNormal"><u></u> <u></u></p> </div> <div> <p class="MsoNormal">Matthias<u></u><u></u></p> </div> <p class="MsoNormal"><br> On Saturday, 9 March 2019 12:52:03 UTC+1, chaimaa Dahri wrote:<u></u><u></u></p> <blockquote style="border-top:none;border-right:none;border-bottom:none;border-left:1pt solid rgb(204,204,204);padding:0cm 0cm 0cm 6pt;margin-left:4.8pt;margin-right:0cm"> <div> <p class="MsoNormal">Dear CP2K Users,<u></u><u></u></p> <div> <p class="MsoNormal">I am trying to compile the script that you will find attached below (EnergyForceSiO2) but this message (<span style="color:red">ERROR.png</span>) keep showing up everytime i run the job.<u></u><u></u></p> </div> <div> <p class="MsoNormal">PLease do you have any idea of the main cause of this problem?<u></u><u></u></p> </div> <div> <p class="MsoNormal">Best regards,<u></u><u></u></p> </div> <div> <p class="MsoNormal">Chaimaa.<u></u><u></u></p> </div> <div> <p class="MsoNormal"><u></u> <u></u></p> <div> <p class="MsoNormal"><u></u> <u></u></p> </div> </div> </div> </blockquote> </div> <p class="MsoNormal">-- <br> You received this message because you are subscribed to the Google Groups "cp2k" group.<br> To unsubscribe from this group and stop receiving emails from it, send an email to <a href="mailto:cp2k+uns...@googlegroups.com" target="_blank">cp2k+uns...@googlegroups.com</a>.<br> To post to this group, send email to <a href="mailto:cp...@googlegroups.com" target="_blank"> cp...@googlegroups.com</a>.<br> Visit this group at <a href="https://groups.google.com/group/cp2k" target="_blank"> https://groups.google.com/group/cp2k</a>.<br> For more options, visit <a href="https://groups.google.com/d/optout" target="_blank"> https://groups.google.com/d/optout</a>.<u></u><u></u></p> </blockquote> </div> <p class="MsoNormal">-- <br> You received this message because you are subscribed to the Google Groups "cp2k" group.<br> To unsubscribe from this group and stop receiving emails from it, send an email to <a href="mailto:cp2k+uns...@googlegroups.com" target="_blank">cp2k+uns...@googlegroups.com</a>.<br> To post to this group, send email to <a href="mailto:cp...@googlegroups.com" target="_blank">cp...@googlegroups.com</a>.<br> Visit this group at <a href="https://groups.google.com/group/cp2k" target="_blank">https://groups.google.com/group/cp2k</a>.<br> For more options, visit <a href="https://groups.google.com/d/optout" target="_blank">https://groups.google.com/d/optout</a>.<u></u><u></u></p> </div> </div> <p></p> -- <br> You received this message because you are subscribed to the Google Groups "cp2k" group.<br> To unsubscribe from this group and stop receiving emails from it, send an email to <a href="mailto:cp2k+uns...@googlegroups.com" target="_blank">cp2k+uns...@googlegroups.com</a>.<br> To post to this group, send email to <a href="mailto:cp...@googlegroups.com" target="_blank">cp...@googlegroups.com</a>.<br> Visit this group at <a href="https://groups.google.com/group/cp2k" target="_blank">https://groups.google.com/group/cp2k</a>.<br> For more options, visit <a href="https://groups.google.com/d/optout" target="_blank">https://groups.google.com/d/optout</a>.<br> </blockquote></div>