Hi Stefaan, <br> <br> Thanks for your reply! I run jobs under bash shell. And the problem connected to particular k-point, that is, big k-mesh. I also tried to give .machines file by hand, and run lapw2 by hand "x lapw2 -p" also, it does not work at all.<br> <br> Best regards,<br> <br> Stargmoon<br><br><b><i>Stefaan Cottenier <Stefaan.Cottenier@fys.kuleuven.be></i></b> wrote:<blockquote class="replbq" style="border-left: 2px solid rgb(16, 16, 255); margin-left: 5px; padding-left: 5px;"> <br>> I am sure I substitute the correct "X" value. I checked lapw2_X.def,<br>> there is no case.klist_X is contained. Only case.kgen is included in<br>> lapw2_X.def. I tried to turn on debug=1 in lapw2para, the output to<br>> case.dayfile stays in "waiting for processes:", and waiting forever.<br><br>This reminds me of a tcsh problem (some versions of tcsh have problems<br>with the 'wait' statement, and indeed wait forever in lapw2). Verify<br>whether that
particular machine has another tcsh than the others. Try to<br>run the same job but distributed over all machines that are not that<br>one: does it run now? (i.e.: is your problem connected to a particular<br>machine, or is it connected to a particular k-point?)<br><br>Stefaan<br><br><br>Disclaimer: http://www.kuleuven.be/cwis/email_disclaimer.htm<br><br>_______________________________________________<br>Wien mailing list<br>Wien@zeus.theochem.tuwien.ac.at<br>http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien<br></blockquote><br><p>
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