CH LSPEC

From VASP Wiki
Revision as of 16:32, 6 December 2021 by Karsai (talk | contribs)

CH_LSPEC = [logical]
Default: CH_LSPEC = .FALSE. 

Description: This flag controls whether the imaginary part of the dielectric function for a selected core electron is calculated and written to the OUTCAR file or not.


How to XAS spectra from core-hole calculations is explained here: SCH calculations.

This feature is only available from VASP version 6.0 or higher.

Related Tags and Sections

CH_SIGMA,CH_NEDOS,ICORELEVEL,CLNT,CLN,CLL,CLZ

Examples that use this tag