Band-structure calculation using meta-GGA functionals: Difference between revisions
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[[Category: | [[Category:Exchange-correlation_functionals]][[Category:Band structure |Band structure]][[Category:Howto|Howto]] |
Revision as of 15:18, 27 February 2025
For band-structure calculations with meta-GGA functionals, follow the same procedure as for band-structure calculations using hybrid functionals. The reason is that a regular k mesh has to be provided in order to compute the kinetic-energy density.
Related tags and articles
KPOINTS, KPOINTS_OPT, Band-structure calculation using hybrid functionals