[Pw_forum] xcrysden chdens plots
Luke Thulin
lukethulin at netscape.net
Thu Jun 22 16:18:07 CEST 2006
Hello everyone,
I'm trying to use xcrysden to view 3D charge density plots. I set iflag
= 3 and output_format = 5 for pp.x input. The pp.x output file doesn't
report any problems and says it wrote the data file in xcrysden format
for a 3D plot. When I try to open the data file in xcrysden it gives a
parse error and won't open it. There seemed to be a similar discussion
about this in the archives but I didn't see if the problem was
resolved. According to the input_pp documentation, it looks to me that
if I choose this output format, I don't need to include any of the e1,
e2, e3, xo, nx, ny, and nz variables, is this correct?
Thanks,
Luke
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