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<div class="moz-cite-prefix">Did you apply the source code fix to
symmetso's clmchange.f of WIEN2k 14.2 and accept the new structure
generated by symmetso during initso [
<a class="moz-txt-link-freetext" href="http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg12523.html">http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg12523.html</a>
]?<br>
<br>
There is clmchange.f at:<br>
<br>
<a class="moz-txt-link-freetext" href="http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg12361.html">http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg12361.html</a><br>
<br>
or you might be interested in using clmchange.patch instead at:<br>
<br>
<a class="moz-txt-link-freetext" href="https://github.com/gsabo/WIEN2k-Patches/tree/master/14.2">https://github.com/gsabo/WIEN2k-Patches/tree/master/14.2</a><br>
<br>
(click "WIEN2k-Patches" link, then "Download ZIP" button)<br>
<br>
On 7/6/2015 4:05 AM, <a class="moz-txt-link-abbreviated" href="mailto:rahnama@hsu.ac.ir">rahnama@hsu.ac.ir</a> wrote:<br>
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<blockquote
cite="mid:147238014.106522.1436177145117.JavaMail.zimbra@hsu.ac.ir"
type="cite">
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<pre style="font-family: courier, 'courier new', monospace; font-size: 14px; white-space: pre-wrap; word-wrap: break-word; margin: 0px; color: #000000; font-style: normal; font-variant: normal; font-weight: normal; letter-spacing: normal; line-height: 19.6000003814697px; orphans: auto; text-align: start; text-indent: 0px; text-transform: none; widows: 1; word-spacing: 0px; -webkit-text-stroke-width: 0px; background-color: #ffffff;" data-mce-style="font-family: courier, 'courier new', monospace; font-size: 14px; white-space: pre-wrap; word-wrap: break-word; margin: 0px; color: #000000; font-style: normal; font-variant: normal; font-weight: normal; letter-spacing: normal; line-height: 19.6000003814697px; orphans: auto; text-align: start; text-indent: 0px; text-transform: none; widows: 1; word-spacing: 0px; -webkit-text-stroke-width: 0px; background-color: #ffffff;">Dear Wien2k users,
I tried to run GGA+U calculation with structure of EuFe4Sb12. I am having problem at the lapwdm step when both -so and -orb are turned on(Error in LAPW2DM). Also,There is not any errors if I run with only the -orb option (no spin-orbit coupling)or visa versa.
</pre>
<pre style="font-family: courier, 'courier new', monospace; font-size: 14px; white-space: pre-wrap; word-wrap: break-word; margin: 0px; color: #000000; font-style: normal; font-variant: normal; font-weight: normal; letter-spacing: normal; line-height: 19.6000003814697px; orphans: auto; text-align: start; text-indent: 0px; text-transform: none; widows: 1; word-spacing: 0px; -webkit-text-stroke-width: 0px; background-color: #ffffff;" data-mce-style="font-family: courier, 'courier new', monospace; font-size: 14px; white-space: pre-wrap; word-wrap: break-word; margin: 0px; color: #000000; font-style: normal; font-variant: normal; font-weight: normal; letter-spacing: normal; line-height: 19.6000003814697px; orphans: auto; text-align: start; text-indent: 0px; text-transform: none; widows: 1; word-spacing: 0px; -webkit-text-stroke-width: 0px; background-color: #ffffff;">Your guidance to solve this problem will be greatly appreciated.
Yours,
Hossein</pre>
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