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Thank you Prof. Blaha,</div>
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You commented;</div>
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____________________</div>
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> After edditing the case.struct file with StructGen I push "save", then I<br>
> get the option of setting the RMT with;<br>
> *set automatically RMT and continue editing <http://localhost:7890/util/<br>
> structrmt.pl?SID=899042>*<br>
> but the RMT remains the same "RMT=2.000" => 2.000<br>
> so it does not find the correct RMT<br>
<br>
After pushing "set automatically RMT and continue editing", it comes<br>
back into the structeditor. Do you see the modified RMTs there ?<br>
Afterwards you still need to save it, to make it active (the<br>
structeditor works on a copy of the struct file).<br>
<br>
If it does not work, execute setrmt on the command line (in a<br>
terminal window in the correct directory. What do you get there ??<br>
__________________________</div>
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After executing </div>
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setrmt</div>
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I got the message that the </div>
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Math::Trig</div>
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package was missing</div>
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after installing it;</div>
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perl</div>
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cpam Math::Trig</div>
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the RMT was modified</div>
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__________________________</div>
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<br>
> Another problem;<br>
> When I open xcrysden in the terminal and I try to<br>
> "Open WIEN2k Struct file"<br>
> and I point to "case.struct" file it opens the crystal structure, but if<br>
> I point to another file, like "case.in0" or any other, it does not<br>
> display the crystal structure and I get the message<br>
> Error: error renaming "case.in0": no such file or di...<br>
<br>
I cannot believe such a question. XCRYSDENS displays a crystal<br>
structure. It needs an imput, which describes the structure. When you<br>
open case.in0, do you think that it can read structural information from<br>
that file ???</div>
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_____________________</div>
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up to now, when I put file like "case.**" it would rename it as "case.struct" and open the crystal structure, but now it gives this message</div>
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Error: error <b>renaming</b> "case.in0": no such file or di...</div>
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it is not a big problem... but I need to point directly to the "case.struct" file</div>
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_____________________</div>
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<br>
</div>
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Saludos</div>
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<br>
</div>
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Pablo</div>
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