Band-structure calculation using meta-GGA functionals: Difference between revisions
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For [[:Category:Band structure|band-structure calculations]] with | For [[:Category:Band structure|band-structure calculations]] with {{TAG|METAGGA}} functionals, follow the same procedure as for [[Band-structure_calculation_using_hybrid_functionals|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== | ==Related tags and articles== | ||
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== References == | == References == | ||
[[Category:Exchange-correlation_functionals]][[Category:Band structure |Band structure]][[Category:Howto|Howto]] | [[Category:Exchange-correlation_functionals]][[Category:Band structure |Band structure]][[Category:Howto|Howto]][[Category:Crystal momentum]] | ||
Latest revision as of 16:05, 20 March 2026
For band-structure calculations with METAGGA 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