[Pw_forum] charge density data in pp.x

[Ruibin Liu]

Hi all,

In pp.x, if plot_num=0, we can get the total charge density data, and if we
set output_format to be 3, it seems that we can also set the density of
 meshgrid as described by the Document for PP. However, whatever I change
the nx, ny and nz numbers to be, the density of meshgrid won't change. Does
anyone know the reasons and how to change the density of meshgrid?

Another question is how the charge density data is arrayed in the
X.rho.dat? Or in other words, are they cycling in x, y, z order?


Best,
Ruibin
-- 
*Liu, Ruibin*
Department of Chemistry
Duke University
Durham, NC, 27708
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