NGZ: Difference between revisions
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Revision as of 10:45, 20 March 2017
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:
where
- [math]\displaystyle{ E_{\rm cut}=\frac{\hbar^2}{2m_e}G_{\rm cut}^2 }[/math]
with Ecut=ENCUT.
Alternatively NGZ may be set to a specific value in the INCAR file.
Related Tags and Sections
NGX, NGY, NGXF, NGYF, NGZF, PREC, ENCUT, ENAUG, ENMAX
