[QE-users] Gamma Point
Lorenzo Paulatto
paulatz at gmail.com
Thu Jul 2 08:50:57 CEST 2020
Hello Felipe,
> K_POINTS (gamma)?
This syntax is betterm because the code will use the property of the
Gamma-point to use real-valued wavefunctions, saving half the memory and
the time on Fourier transforms...
But some codes (es. phonon) do not work with Gamma-point tricks, in that
case you have to use the following syntax to ensure compatibility
> K_POINTS (automatic)
> 1 1 1 0 0 0 or
cheers
>
>
> Regards.
>
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Lorenzo Paulatto - Paris
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