XAS - Tutorial: Difference between revisions

From VASP Wiki
No edit summary
No edit summary
 
(2 intermediate revisions by one other user not shown)
Line 1: Line 1:
(UNDER CONSTRUCTION)
{{Template:XAS - Tutorial}}
{{Template:XAS - Tutorial}}


Line 12: Line 10:
</div>
</div>


[[Category:Tutorials]][[Category:VASP6]]
[[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: