LELF: Difference between revisions
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the {{FILE|INCAR}} file in addition | the {{FILE|INCAR}} file in addition | ||
== Related | == Related tags and articles == | ||
{{TAG|NPAR}} | {{TAG|NPAR}} | ||
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[[The_VASP_Manual|Contents]] | [[The_VASP_Manual|Contents]] | ||
[[Category:INCAR]][[Category:Electronic | [[Category:INCAR]][[Category:Electronic minimization]] | ||
Revision as of 13:47, 6 April 2022
LELF = .TRUE. | .FALSE.
Default: LELF = .FALSE.
Description: LELF determines whether to create an ELFCAR file or not.
This file contains the so-called ELF (electron localization function) [1]
If LELF is set, NPAR=1 has to be set explicitely in the INCAR file in addition