<div dir="ltr">Dear Ralph,<div> I am able to successfully complied cp2k with plumed using the instruction provided in http://cp2k.org/howto:install_with_plumed. However, when I am running the cp2k run I am getting the following segmentation fault error. </div><div><br></div><div><div>forrtl: severe (174): SIGSEGV, segmentation fault occurred</div><div>Image PC Routine Line Source</div><div>cp2k.popt 00000000029AF569 Unknown Unknown Unknown</div><div>cp2k.popt 00000000029ADE3E Unknown Unknown Unknown</div><div>cp2k.popt 0000000002958842 Unknown Unknown Unknown</div><div>cp2k.popt 0000000002909993 Unknown Unknown Unknown</div><div>cp2k.popt 000000000290EA7B Unknown Unknown Unknown</div><div>libpthread.so.0 0000003D1FA0F710 Unknown Unknown Unknown</div><div>cp2k.popt 000000000058CDD9 Unknown Unknown Unknown</div><div>cp2k.popt 0000000000589A5F Unknown Unknown Unknown</div><div>cp2k.popt 0000000000493D3B Unknown Unknown Unknown</div><div>cp2k.popt 0000000000491130 Unknown Unknown Unknown</div><div>cp2k.popt 00000000004136AD Unknown Unknown Unknown</div><div>cp2k.popt 0000000002964768 Unknown Unknown Unknown</div><div>libc.so.6 0000003D1F21ED5D Unknown Unknown Unknown</div><div>cp2k.popt 0000000000412829 Unknown Unknown Unknown</div><div>forrtl: severe (174): SIGSEGV, segmentation fault occurred</div></div><div>....</div><div>...</div><div><br></div><div>Any suggestion how can i solve this problem? </div><div><br></div><div>Thanks a lot in advance </div><div><br></div><div>Best, abhi</div><div><br></div><div><br></div><div><br>On Thursday, 5 February 2015 11:02:05 UTC+1, Ralph wrote:<blockquote class="gmail_quote" style="margin: 0;margin-left: 0.8ex;border-left: 1px #ccc solid;padding-left: 1ex;"><div dir="ltr"><div><div><div>Dear Bin,<br><br></div>Currently there is no interface for cp2k with PLUMED 2.0. There have been some ideas to provide this functionality, but at the moment you can't compile PLUMED 2.0 with cp2k.<br></div>As for the 1.3 version, compiling should work according to the instructions on the cp2k wiki [1].<br><br></div>Best,<br>Ralph<br><br>[1] <a href="http://cp2k.org/howto:install_with_plumed" target="_blank" rel="nofollow" onmousedown="this.href='http://www.google.com/url?q\75http%3A%2F%2Fcp2k.org%2Fhowto%3Ainstall_with_plumed\46sa\75D\46sntz\0751\46usg\75AFQjCNHC_B5xfw9dIVaWnYHVNNao1HjdOA';return true;" onclick="this.href='http://www.google.com/url?q\75http%3A%2F%2Fcp2k.org%2Fhowto%3Ainstall_with_plumed\46sa\75D\46sntz\0751\46usg\75AFQjCNHC_B5xfw9dIVaWnYHVNNao1HjdOA';return true;">http://cp2k.org/howto:install_<wbr>with_plumed</a><br><div><br></div></div><div><br><div class="gmail_quote">On Wed, Feb 4, 2015 at 7:44 PM, Bin Gu <span dir="ltr"><<a href="javascript:" target="_blank" gdf-obfuscated-mailto="7QKO3MOkJ_wJ" rel="nofollow" onmousedown="this.href='javascript:';return true;" onclick="this.href='javascript:';return true;">gub...@gmail.com</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="ltr">Dear Matt: <br><br>Thanks for response. <br><br>It has been found that this problem was just the result of compiling time exceeded time limitation (by finding some -D) of Intel fortran setting. <br><br>We are trying to understanding the compile example of cp2k and plumed 1.3. and, then, compile the cp2k(2.5) with plumed 2.0. <br>To this end, it seems there are some interface problems. <br><br>Best regards, <br><br>Bin Gu <br><div><div><br><br><blockquote class="gmail_quote" style="margin:0;margin-left:0.8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="ltr">Hi,<div><br></div><div>what version of cp2k, and which compiler? I think some older compilers had problems with ewalds_multipole.</div><div><br></div><div>Does cp2k compile without plumed?</div><div><br></div><div>Matt<br><br>On Friday, January 30, 2015 at 6:48:14 PM UTC, Bin Gu wrote:<blockquote class="gmail_quote" style="margin:0;margin-left:0.8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="ltr">Hi, everyone:<br><br>When I try to compile cp2k with plumed. At the last step, I meet a problem as: <br><br>catastrophic error: **Internal compiler error: CPU time limit exceeded signal raised** Please report this error along with the circumstances in which it occurred in a Software Problem Report. Note: File and line given may not be explicit cause of this error.<br>compilation aborted for ewalds_multipole_debug.f90 (code 1)<br>make[1]: *** [ewalds_multipole_debug.o] Error 1<br>make[1]: Leaving directory `/s/bingu/cp2k-plumed/cp2k/<u></u>obj<wbr>/lobster/popt'<br>make: *** [build] Error 2<br><br><br>Does anyone have meet the similar problem ? Many thanks for any clue.<br><br>Regards, <br><br>Bin Gu<br></div></blockquote></div></div></blockquote></div></div></div><div><div>
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