[Wien] multiple fatbands plot
Gavin Abo
gsabo at crimson.ua.edu
Tue Sep 19 09:32:52 CEST 2017
I forgot, you may be right that WIEN2k can only plot one band character
at a time. To plot more than one, you might need to create your own
plot using a graphing software (like Origin, gnuplot, matlab, etc.) or
use Spaghetti-primavera. See the unsupported page for Spaghetti-primavera:
http://susi.theochem.tuwien.ac.at/reg_user/unsupported/
On 9/19/2017 1:14 AM, Wen Fong Goh wrote:
>
> 11 and 12 correspond to dxz and dyz (not quite t2g in cubic sym.).
> Ideally, I would like to have a fatband for dxz and another (different
> color) for dyz. What I found is even though line 11 (jatom jtype ...)
> is repeated, only the last line will be plotted, it can easily be
> checked by setting the size on the first line to be large.
>
> 2 11 2.0 # jatom, jtype, size of heavier
> plotting
> 2 12 0.2 # jatom, jtype, size of heavier
> plotting
>
>
> For the TiC example in the WIEN2k usersguide, jtype of 6 should
> correspond to t2g. What is 11 and 12 in your case? Not sure if 11 or
> 12 are too high of a number and don't correspond to anything.
>
> The "line switch" might need to be set to 2 in your case.insp and
> sometimes I think the circle size (size of heavier plotting) of 0.2
> might be too small to show the fat bands. You might have to increase
> it so that it doesn't hide itself as a thin line.
> On 9/18/2017 9:30 PM, Wen Fong Goh wrote:
>
> Hi, how do you plot multiple fatbands? I tried adding another line
> in case.insp after jatom jtype ... line but it doesn't work. 2
> 11 0.2 # jatom, jtype, size of heavier
> plotting 2 12 0.2 # jatom, jtype, size
> of heavier plotting
>
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