NGZ

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Revision as of 07:49, 17 October 2023 by Ftran (talk | contribs)

NGZ = [integer]
Default: NGZ = set in accordance with PREC and ENCUT 

Description: NGZ sets the number of grid points in the FFT grid along the third lattice vector.


By default NGZ is set in accordance with the requested "precision" mode (PREC) and the plane wave kinetic energy cutoff ENCUT:

PREC NGZ
Normal 3/2×Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://www.vasp.at/wiki/restbase/vasp.at/v1/":): G_{{{\rm {cut}}}}
Single (VASP.5) 3/2×Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://www.vasp.at/wiki/restbase/vasp.at/v1/":): G_{{{\rm {cut}}}}
Single (VASP.6) Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://www.vasp.at/wiki/restbase/vasp.at/v1/":): G_{{{\rm {cut}}}}
SingleN (VASP.6) 3/2×Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://www.vasp.at/wiki/restbase/vasp.at/v1/":): G_{{{\rm {cut}}}}
Accurate Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://www.vasp.at/wiki/restbase/vasp.at/v1/":): G_{{{\rm {cut}}}}
Low 3/2×Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://www.vasp.at/wiki/restbase/vasp.at/v1/":): G_{{{\rm {cut}}}}
Medium 3/2×Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://www.vasp.at/wiki/restbase/vasp.at/v1/":): G_{{{\rm {cut}}}}
High Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://www.vasp.at/wiki/restbase/vasp.at/v1/":): G_{{{\rm {cut}}}}

where

Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://www.vasp.at/wiki/restbase/vasp.at/v1/":): E_{{{\rm {cut}}}}={\frac {\hbar ^{2}}{2m_{e}}}G_{{{\rm {cut}}}}^{2}

with Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://www.vasp.at/wiki/restbase/vasp.at/v1/":): E_{{{\rm {cut}}}} =ENCUT.

Alternatively, NGZ can be set to a specific value in the INCAR file.

Related tags and articles

NGX, NGY, NGXF, NGYF, NGZF, PREC, ENCUT, ENAUG, ENMAX

Examples that use this tag