[Pw_forum] How to calculate inverse participation ratio (IPR) using espresso?

reza vatan rezavatan64 at gmail.com
Fri Jul 24 02:12:45 CEST 2015


Dear all,

I obtained the DOS plot (the attachment) of a-Si generated by a supercell
containing 64 atom using QE. For finding mobility edge in my DOS plot, I'm
willing to calculate the inverse participation ratio of the electronic
states in the plot as a measure of localization. I'm wondering if there is
any way to calculate IPR using Espresso output files.

Any suggestion would be highly appreciated.

Thanks in advance.

Best,
Reza
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