[Wien] Units in case.qtldn file
Lukasz Plucinski
pluto at physics.ucdavis.edu
Thu May 21 15:43:35 CEST 2009
Hello,
I did spin-polarized Fe(100) slab calculation to get minority surface
states. I wrote a script to read case.qtldn and case.outputirdn to plot
only bands of the certain symmetry (because photoemission in my geometry
can only see even states). To see surface states nicely I plot only
these which have more than 0.2 total charge in case.qtldn file (atom and
k-resolved). Of course this "0.2" is an arbitrary number, but for my
particular case it produces nice and clear picture.
My question is trivial, and most likely it has been answered many times
before:
What are the units of this "0.2" number ? What are the units in the
case.qtldn file ?
Lukasz
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