<html><body><div style="color:#000; background-color:#fff; font-family:times new roman, new york, times, serif;font-size:10pt"><div><span>Dear Lucy,</span></div><div><span>Please, provide your struct file and specify exactly what you want to do. Or are you using the same Pb struct file?<br></span></div><div> </div><div><font style="BACKGROUND-COLOR:#00ff80;"><span style="COLOR:black;FONT-SIZE:18pt;FONT-WEIGHT:bold;">Regards</span><b><b><i><font face="Wingdings" size="6" color="black"><span class="yui_3_2_0_125_1340151389508130" style="FONT-STYLE:italic;FONT-FAMILY:Wingdings;COLOR:black;FONT-SIZE:24pt;" lang="EN-GB">?</span></font></i></b></b></font></div><div><font style="BACKGROUND-COLOR:rgb(128,255,192);" face="times new roman, new york, times, serif" size="4" color="#2d2d2d"><b>Chinedu Ekuma Ekuma</b></font></div><div><font face="times new roman, new york, times, serif" size="4" color="#0000bf">Department of Physics and
Astronomy </font></div><div><font face="times new roman, new york, times, serif" size="4" color="#0000bf">Louisiana State University </font></div><div><font face="times new roman, new york, times, serif" size="4" color="#0000bf">202 Nicholson Hall, Tower
Dr </font></div><div><font face="times new roman, new york, times, serif" size="4" color="#0000bf">Baton Rouge, Louisiana, 70803-4001 </font></div><div><font face="times new roman, new york, times, serif" size="4" color="#0000bf"><i> <br></i></font></div><div><font
face="times new roman, new york, times, serif" size="4" color="#0000bf"><i><br></i></font> </div><div style="COLOR:rgb(255,0,0);"><font face="times new roman, new york, times, serif" size="3"><i>...The Ways of God are Mysterious</i></font></div><div><font face="times new roman, new york, times, serif" size="3" color="#0000bf"><i> As Always</i></font></div><div><font face="times new roman, new york, times, serif" size="4" color="#0000bf"><i><font size="3"><span style="BACKGROUND-COLOR:rgb(96,191,0);COLOR:rgb(3,61,61);">I wish you God's PANACEA</span></font><br></i></font></div><div><font face="times new roman, new york, times, serif" size="4" color="#0000bf"><i><br></i></font></div><div><font face="times new roman, new york, times, serif" size="4" color="#0000bf"><i> </i></font><font face="times new roman,
new york, times, serif" size="4" color="#0000bf"><i> </i></font></div><div><font size="4" color="#ff0000"></font> </div><div><font size="4" color="#ff0000"></font> </div><div><font size="4"><font color="#00007f"> </font></font></div><div><br></div> <div style="font-family: times new roman, new york, times, serif; font-size: 10pt;"> <div style="font-family: times new roman, new york, times, serif; font-size: 12pt;"> <div dir="ltr"> <font face="Arial" size="2"> <hr size="1"> <b><span style="font-weight:bold;">From:</span></b> Lucy Kiruri <lkirur1@tigers.lsu.edu><br> <b><span style="font-weight: bold;">To:</span></b> wien@zeus.theochem.tuwien.ac.at <br> <b><span style="font-weight: bold;">Sent:</span></b> Thursday, June 21, 2012 1:40 PM<br> <b><span style="font-weight:
bold;">Subject:</span></b> [Wien] structeditor load struct problem with octave<br> </font> </div> <br>
<div id="yiv1240196415">Dear Slomski,<div>I am have the same problem you had with wien2k while generating a slab. I tried to check for responses but i didn't see any. below is the question am referring too:</div><div>****************************************************************************************************************</div>
<div><pre>Dear developers and users of Wien2k,
during the workshop I have learned how to create a slab using the
supercell tool and structeditor tool written in octave. With supercell
everything works fine, but I need structeditor because the atoms "grow"
in [111] direction. The steps were quite clear and it worked. On my
system, however it fails, and so far I need help. These are the
steps,which I used to creat a slab.
1) creating a unit cell as usually will give me name.struct (in my case
Pb.struct)
2) then i went to the directory where name.struct is and started octave
3) s = loadstruct(Pb.struct)
After this I get the error:
octave:2> s=loadstruct(Pb2.struct)
error: `Pb2' undefined near line 2 column 14
error: evaluating argument list element number 1
error: evaluating assignment expression near line 2, column 2oble
I also tried s=loadstruct("Pb2.struct")
But this gave me the <a rel="nofollow" title="Powered by Text-Enhance" id="yiv1240196415_GPLITA_0" target="_blank" href="http://zeus.theochem.tuwien.ac.at/pipermail/wien/2010-August/013550.html#">error message</a>:
octave:3> s = loadstruct("Pb2.struct")
error: `strcmp' undefined near line 18 column 11
error: if: error evaluating conditional expression
error: evaluating if command near line 18, column 7
error: called from `loadstruct' in file
`/home5/slomski/build/SRC_structeditor/bin/loadstruct.m'
error: evaluating assignment expression near line 3, column 3
I also scanned the mailing list, but did not found any solution to this
problem.
I am thankful for any hint on this.
</pre><br class="yiv1240196415Apple-interchange-newline"><div>*************************************************************************************************</div><div>How did you solve this problem. Please help me. Thank You.</div>
<div>Warm Regards.</div>-- <br><span style="font-family:arial, sans-serif;font-size:13px;border-collapse:collapse;color:rgb(34,34,34);"><div style="margin-top:0px;margin-right:0px;margin-bottom:0px;margin-left:0px;"><font style="font:normal normal normal 12px/normal Helvetica;" size="3"><font color="#3366FF"><font face="'comic sans ms', sans-serif">Lucy W. Kiruri</font></font></font></div>
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<div style="margin-top:0px;margin-right:0px;margin-bottom:0px;margin-left:0px;"><font style="font:normal normal normal 12px/normal Helvetica;" size="3"><font color="#3366FF"><font face="'comic sans ms', sans-serif">Baton Rouge, LA 70803-1804</font></font></font></div>
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