<div dir="auto"><div>Please read!<div dir="auto"><br></div><div dir="auto">The message says that you cannot ssh to the same machine. This is a setup issue. Without more information (.machines file) nobody can help; they probably cannot help with the information as this is 99% probability an issue of your OS setup, not Wien2k.</div><div dir="auto"><br><div data-smartmail="gmail_signature" dir="auto">_____<br>Professor Laurence Marks<br>"Research is to see what everybody else has seen, and to think what nobody else has thought", Albert Szent-Györgyi<br><a href="http://www.numis.northwestern.edu">www.numis.northwestern.edu</a></div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Thu, Sep 2, 2021, 11:47 Ashwani Kumar <<a href="mailto:ashwani.ism@gmail.com">ashwani.ism@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="ltr"><div>Hello everyone, <br></div><div>    Recently, I have upgraded wien2k version (from ver19 to ver21) and OS ( ubuntu 18.04 to 20.04 LTS). I have followed the procedure as described in thread <br></div><div><a href="https://urldefense.com/v3/__https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg21134.html__;!!Dq0X2DkFhyF93HkjWTBQKhk!D_wAO6wPa7cjHnAwiMWnH6C8wQztOBnMgSLEGImbk2SdDOcKg4gG8Q4VObCqZudSave-nw$" target="_blank" rel="noreferrer">https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg21134.html</a></div><div>i am getting the error during initialization of the calculation for dstart. </div><div> " next is dstart <br>>   dstart  -p > & .mist        (17:12:16)  <br> stop error"<br></div><div><br></div><div>An empty "dstart.error" file is generated.</div><div><br></div><div>When dstart program is called individually with and without -p switch, these are results.</div><div>ser@user:~/WIEN2k/STO$ x dstart -p<br></div><div>starting parallel dstart at Thursday 02 September 2021 05:22:41 PM IST<br>-------- .machine0 : 1 processors<br>running dstart remotely on localhost<br>ssh: connect to host localhost port 22: Connection refused<br>0.053u 0.020s 0:00.07 100.0% 0+0k 0+48io 0pf+0w<br>error: command   /apps/code/wien2k/dstartpara dstart.def   failed<br>user@user:~/WIEN2k/STO$ x dstart<br>STOP DSTART ENDS<br>1.659u 0.287s 0:00.45 428.8% 0+0k 0+600io 0pf+0w<br></div><div><br></div><div><div> dstart without -p executes successfully. With -p switch, def failed.</div><div>Please help how to solve this.</div><div><br></div><div>Regards,</div><div>A. kumar </div><div></div></div></div>
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