<html>
<head>
<meta http-equiv="Content-Type" content="text/html; charset=UTF-8">
</head>
<body>
<p>The WIEN2k updates page [1] has:</p>
<p><br>
</p>
<p><b>VERSION_21: 10.4.2021 </b><br>
</p>
<p>...</p>
<p><br>
</p>
<p><b><span class="ILfuVd"><span class="hgKElc"><b>• </b></span></span>SRC_spaghetti:</b>
bz_lin.f: consistent use of toler (fixing additional black lines)<br>
</p>
<p><br>
</p>
<p>Have you tried WIEN2k 21.1 having the above band structure black
lines fix?</p>
<p><br>
</p>
<p>You might also have to be careful with the band structure
commands with there being differences for the SOC case [2,3].<br>
</p>
<br>
<p>[1] <a class="moz-txt-link-freetext" href="http://www.wien2k.at/reg_user/updates/">http://www.wien2k.at/reg_user/updates/</a><br>
</p>
<p>[2]
<a class="moz-txt-link-freetext" href="https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg13143.html">https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg13143.html</a><br>
</p>
<p>[3]
<a class="moz-txt-link-freetext" href="https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg12338.html">https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg12338.html</a></p>
<p><br>
</p>
<div class="moz-cite-prefix">On 5/9/2022 4:41 PM, delamora wrote:<br>
</div>
<blockquote type="cite"
cite="mid:SN6PR06MB5311C8A204CD6EDB0BBA35F5CBC69@SN6PR06MB5311.namprd06.prod.outlook.com">
<meta http-equiv="Content-Type" content="text/html; charset=UTF-8">
<style type="text/css" style="display:none;">P {margin-top:0;margin-bottom:0;}</style>
<div id="divRplyFwdMsg" dir="ltr">
<div class="x_elementToProof elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
Dear Wien community,</div>
</div>
<div dir="ltr">
<div dir="ltr">
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
I am doing a calculation with SOC, and when I try to plot
the band structure without SOC</div>
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
spaghetti -p -up<br>
</div>
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
it looks fine</div>
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<br>
</div>
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
but when I put it with SOC<br>
</div>
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
spaghetti -p -up -so</div>
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
I get a bandstructure with many vertical lines</div>
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<br>
</div>
<div class="x_x_elementToProof elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
Is there a way to fix it?</div>
<div class="x_x_elementToProof elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
(WIEN2k-19.1)<br>
</div>
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<br>
</div>
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
Thanks</div>
<div class="x_x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<br>
</div>
<div class="x_x_elementToProof x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
Pablo</div>
<div class="x_x_elementToProof x_elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
===============</div>
<div class="x_x_elementToProof x_elementToProof
elementToProof"
style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
I sent a message with a bandstructure, and it was too big<br>
</div>
</div>
</div>
</blockquote>
<pre class="moz-quote-pre" wrap="">
</pre>
</body>
</html>