[Pw_forum] How to use pp.x and xcrysden to plot 3d charge density
dan.gil9973 at gmail.com
Tue Feb 6 20:25:29 CET 2018
Thank you very much! I was able to generate plots.
On Tue, Feb 6, 2018 at 4:06 AM, Matic Poberznik <matic.poberznik at gmail.com>
> Dear Dan,
> > &PLOT
> > nfile = 1 ,
> > weight(1) = 1.0,
> > /
> > -----
> See the output_format keyword from the &PLOT namelist:
> what you are looking for is: output_format = 3 or output_format = 5 and
> fileout = 'your.xsf';
> also note that the file can be rewritten in the desired format from the
> pp generated file with pp.x using the inputpp keyword (inputpp='out' in
> your case because of the name you originally specified for the
> "filplot" keyword).
> Best Regards,
> Matic Poberznik
> J. Stefan Institute, Jamova 39, 1000 Ljubljana, Slovenia
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