LAECHG

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Revision as of 02:54, 22 August 2018 by Vaspmaster (talk | contribs)

LAECHG = .TRUE. | .FALSE.
Default: LAECHG = .FALSE. 

Description: when LAECHG=.TRUE. the all-electron charge density will be reconstructed explicitly and written out to file.


If LAECHG=.TRUE. is set VASP will reconstruct the all-electron charge density on the so-called "fine" FFT-grid.

The "fine" FFT-grid consists of NGXF×NGYF×NGZF points in real space (i.e., the grid that is used to represent the augmented pseudo charge densities of the USPP and PAW methods).

Related Tags and Sections

AECCAR0, AECCAR1, AECCAR2

Examples that use this tag


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