<html>
<head>
<meta http-equiv="Content-Type" content="text/html; charset=utf-8">
</head>
<body style="word-wrap: break-word; -webkit-nbsp-mode: space; -webkit-line-break: after-white-space;" class="">
Hi,
<div class=""><br class="">
</div>
<div class="">I’m not sure if the Slater Koster potentials you refer to is what I have in mind (the Slater-Koster Tight binding parameters).</div>
<div class="">In any case: no, Wannier90 does not compute them automatically. The ‘slater-koster’ string in the code should only refer to the definition of the phase factor when performing band-structure interpolation, and how to truncate TB matrix elements
to reduce the number of neighbours.</div>
<div class=""><br class="">
</div>
<div class="">Giovanni</div>
<div class=""> </div>
<div class=""><br class="">
<div class="">
<div style="color: rgb(0, 0, 0); font-family: Helvetica; font-size: 12px; font-style: normal; font-variant-caps: normal; font-weight: normal; letter-spacing: normal; orphans: auto; text-align: start; text-indent: 0px; text-transform: none; white-space: normal; widows: auto; word-spacing: 0px; -webkit-text-size-adjust: auto; -webkit-text-stroke-width: 0px;">
-- <br class="">
Giovanni Pizzi<br class="">
Theory and Simulation of Materials and MARVEL, EPFL<br class="">
<a href="http://people.epfl.ch/giovanni.pizzi" class="">http://people.epfl.ch/giovanni.pizzi</a><br class="">
http://nccr-marvel.ch/en/people/profile/giovanni-pizzi</div>
</div>
<br class="">
<div>
<blockquote type="cite" class="">
<div class="">On 2 Jul 2018, at 12:46, Alex.Durie <<a href="mailto:alex.durie@open.ac.uk" class="">alex.durie@open.ac.uk</a>> wrote:</div>
<br class="Apple-interchange-newline">
<div class="">
<div class="">Hi,<br class="">
<br class="">
In section 2.9.12 of the Wannier90 manual, it makes reference to Wannier90 computing the interpolated bandstructure using the Slater Koster interpolation scheme.<br class="">
<br class="">
Does this mean Wannier90 computes Slater Koster potentials? If so, where does it store them?<br class="">
<br class="">
Many thanks<br class="">
<br class="">
Alex Durie<br class="">
PhD student<br class="">
The Open University<br class="">
United Kingdom<br class="">
</div>
_______________________________________________<br class="">
Wannier mailing list<br class="">
<a href="mailto:Wannier@lists.quantum-espresso.org" class="">Wannier@lists.quantum-espresso.org</a><br class="">
https://lists.quantum-espresso.org/mailman/listinfo/wannier<br class="">
</div>
</blockquote>
</div>
<br class="">
</div>
</body>
</html>