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May 2016

Creating membership files from xyz files

admin's picture
Submitted by admin on Fri, 05/13/2016 - 17:33

Let's say you want to plot the density of states for a molecular complex, you must separate it into its components and create membership files for each part of the complex. You can now easily do that by just preparing the individual geometry (xmol) files for the different parts of the molecule, and then create the membership files from those.

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