XAS - Tutorial: Difference between revisions
m (Karsai moved page XAS to XAS - Tutorial) |
No edit summary |
||
| (One intermediate revision by one other user not shown) | |||
| Line 1: | Line 1: | ||
{{Template:XAS - Tutorial}} | {{Template:XAS - Tutorial}} | ||
| Line 12: | Line 10: | ||
</div> | </div> | ||
[[Category:Tutorials | [[Category:Tutorials]] | ||
Latest revision as of 09:05, 21 February 2024
This tutorial explains how to calculate the X-ray absorption spectrum (XAS) of a given compound in particular the edge and near edge region. The respective spectroscopy is often called XANES (X-ray absorption near edge structure) or NEXAFS (near edge X-ray absorption fine structure).
This tutorial requires VASP 6.0 or higher.
The tutorial is made of the following parts: