There's not enough information here to help you.<br><br><div class="gmail_quote"><div dir="auto" class="gmail_attr">On Friday, December 3, 2021 at 9:13:25 AM UTC-5 gibu...@gmail.com wrote:<br/></div><blockquote class="gmail_quote" style="margin: 0 0 0 0.8ex; border-left: 1px solid rgb(204, 204, 204); padding-left: 1ex;"><div>Hello, </div><div><br></div><div>I am very new to cp2k and I just tried to run single point calculation with just 2 atoms of Si and I received this error. I don't have any idea what this error means. Can anyone please help me:</div><div><br></div><div><br></div><div>*******************************************************************************</div><div> *   ___                                                                       *</div><div> *  /   \                                                                      *</div><div> * [ABORT]                                                                     *</div><div> *  \___/                             CPASSERT failed                          *</div><div> *    |                                                                        *</div><div> *  O/|                                                                        *</div><div> * /| |                                                                        *</div><div> * / \                                                  cp_ddapc_methods.F:882 *</div><div> *******************************************************************************</div><div><br></div><div><br></div><div> ===== Routine Calling Stack =====</div><div><br></div><div>            6 cp_ddapc_create</div><div>            5 cp_ddapc_init</div><div>            4 qs_env_update_s_mstruct</div><div>            3 qs_energies_init_hamiltonians</div><div>            2 qs_energies</div><div>            1 CP2K</div><div><br></div></blockquote></div>

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