<html><head></head><body><div style="font-family:verdana, helvetica, sans-serif;font-size:16px;"><div><div>Probably the note of Prof. <span>Stefaan Cottenier (see chapter 7) @ </span><a href="http://susi.theochem.tuwien.ac.at/reg_user/textbooks/DFT_and_LAPW_2nd.pdf" rel="nofollow" target="_blank">http://susi.theochem.tuwien.ac.at/reg_user/textbooks/DFT_and_LAPW_2nd.pdf</a> </div><div>will help you for your first question. </div><div><br></div><div>Regards.</div><div class="ydp2040becsignature"><p style="font-family:verdana, helvetica, sans-serif;font-size:16px;"><b><font size="3" face="verdana, helvetica, sans-serif"><i>Lawal <br></i></font></b></p></div></div>
<div><br></div><div><br></div>
<div id="yahoo_quoted_7320595585" class="yahoo_quoted">
<div style="font-family:'Helvetica Neue', Helvetica, Arial, sans-serif;font-size:13px;color:#26282a;">
<div>
On Tuesday, May 15, 2018, 10:38:14 AM GMT+8, Gavin Abo <gsabo@crimson.ua.edu> wrote:
</div>
<div><br></div>
<div><br></div>
<div><div id="yiv2103431220">
<div>
<p><font face="Times New Roman">I'm fairly certain that the
asterisk's symbol (*) corresponds to the <i>s</i> = -1 column
for the orbital quantum number (<i>j</i>) in Table 6.6 on page
107 in the WIEN2k 17.1 usersguide [
<a rel="nofollow" class="yiv2103431220moz-txt-link-freetext" target="_blank" href="http://susi.theochem.tuwien.ac.at/reg_user/textbooks/usersguide.pdf">http://susi.theochem.tuwien.ac.at/reg_user/textbooks/usersguide.pdf</a>
]. For example, p* is the 1/2. Without the asterisk, the p is
the 3/2 in the s = +1 column. <br>
</font></p>
<p>From what I have read, the :BAN label block in case.scf or
case.scf2* shows only the bands around EF [
<a rel="nofollow" class="yiv2103431220moz-txt-link-freetext" target="_blank" href="https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg13238.html">https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg13238.html</a>
].<br>
</p>
<div class="yiv2103431220moz-cite-prefix">On 5/14/2018 4:31 PM, Sergio Castillo
Robles wrote:<br>
</div>
<blockquote type="cite">
<div dir="ltr">
<div>
<div>
<div>
<div>Hi dear Wien users,<br>
<br>
I am running the latest version of wien2k, 17.1<br>
<br>
</div>
I have a couple of questions about output files generated
with wien2k, I was looking for answers in the UG and other
sites but i couldn't find the answer.<br>
<br>
</div>
The first question is about the asterisks simbols that
appears after the selection of the separation energy between
core and valence states in lstart, I can see that some
orbitals are tagged with an asterisk, what are the asterisk
standing for? Maybe its an obvious answer but i can't figure
it out.<br>
<br>
</div>
The other question is about the bands showing in the scf2
file, why does it only shows a fraction of the total bands?
(apparently the last 16 bands) <br>
<br>
</div>
Thanks for your time and patience. Best regards.<br>
</div>
</blockquote>
</div>
</div>_______________________________________________<br>Wien mailing list<br><a ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a><br><a href="http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien" target="_blank">http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien</a><br>SEARCH the MAILING-LIST at: <a href="http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html" target="_blank">http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html</a><br></div>
</div>
</div></div></body></html>