<div dir="ltr"><div><br></div><div>Dear Sir,</div><div><br></div><div><br></div><div>I am running wien2k version on Ubuntu system.</div><div>i am calculating for band structure of Mn2FeZ heusler alloys using PBE-GGA 96 approximation, Rmt*Kmax = 7.0 </div>
<div>i give k-mesh point = 48 </div><div>X lapw1 band up &amp; down calculation successfully run. but when using <span style="color:rgb(0,0,0);font-family:Helvetica,Arial,sans-serif;background-color:rgb(240,240,240)">Commandline: </span><b style="color:rgb(0,0,0);font-family:Helvetica,Arial,sans-serif;background-color:rgb(240,240,240)">x spaghetti -up following problem occured.</b> </div>
<div><br></div><p style="font-family:Helvetica,Arial,sans-serif;margin-top:0px;color:rgb(0,0,0);font-size:medium;background-color:rgb(240,240,240)">Commandline: <b>x spaghetti -up </b><br>Program input is: <b>&quot;&quot;</b> <br>
<br></p><table border="1" style="font-family:Helvetica,Arial,sans-serif;border:0px;padding:2px"><tbody><tr style="border:0px;padding:0px"><td style="font-family:Helvetica,Arial,sans-serif;border:0px;padding:0px"><pre style="font-family:Courier,fixed">
 number of k-points read in case.vector=         111
forrtl: severe (59): list-directed I/O syntax error, unit 5, file /home/nrl/WIEN2k/Mn2FeZ/Mn2FeSi/Mn2FeSi.insp
Image              PC        Routine            Line        Source             
spaghetti          080CECCF  Unknown               Unknown  Unknown
spaghetti          080CD9C5  Unknown               Unknown  Unknown
spaghetti          080A94F1  Unknown               Unknown  Unknown
spaghetti          0809630E  Unknown               Unknown  Unknown
spaghetti          08095B92  Unknown               Unknown  Unknown
spaghetti          08076956  Unknown               Unknown  Unknown
spaghetti          08055B89  inview_                    32  inview.f
spaghetti          0805B6D2  MAIN__                    363  spag.f
spaghetti          0804A104  Unknown               Unknown  Unknown
libc.so.6          400A44D3  Unknown               Unknown  Unknown
0.0u 0.0s 0:00.02 100.0% 0+0k 0+48io 0pf+0w
error: command   /home/nrl/WIEN2k/spaghetti upspaghetti.def   failed

</pre></td></tr></tbody></table><p></p><h4 style="font-family:Helvetica,Arial,sans-serif;margin-top:10px;color:rgb(0,0,0);font-size:medium;background-color:rgb(240,240,240)">Continue with</h4><table style="font-family:Helvetica,Arial,sans-serif;border:0px;padding:2px;background-color:rgb(240,240,240)">
<tbody><tr valign="bottom" style="border:0px;padding:0px"><td style="font-family:Helvetica,Arial,sans-serif;border:0px;padding:0px"><form action="http://nrl61:7891/exec/next.pl" method="POST" style="border:0px;padding:2px">
<input type="SUBMIT" value="continue with bandstructure"></form></td></tr></tbody></table><div><br></div>-- <br><div style="text-align:left">Warm Regards,<br>Vivek Kumar Jain<br>09413635180</div>
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