Category:INCAR

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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

Related Tags and Sections

NPAR

References

  1. ↑ [http://www.nature.com/nature/journal/v371/n6499/pdf/371683a0.pdf B. Silvi and A. Savin, Nature 371, 683-686 (1994).] 
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Contents

Pages in category "INCAR"

The following 7 pages are in this category, out of 7 total.

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