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Band selective electron density map


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  • From: "Patrick B. Hillyard" <phillyar@stanford.edu>
  • To: <forum@abinit.org>
  • Subject: Band selective electron density map
  • Date: Tue, 18 Mar 2008 10:48:32 -0700

Dear ABINITers,
I am performing calculations using semicore pseudopotentials and am
interested in making electron density plots. I am outputting the density,
using cut3d to format the file, and using an external utility to plot.
However, I am only interested in viewing the valence electron density. Is
there a way to exclude the semicore bands that are included since I am using
a semicore pseudopotential?

Thanks for any help,
Patrick Hillyard




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