[QE-users] Dielectric function at temperature greater than 0 K

Md. Jahid Hasan Sagor md.sagor at maine.edu
Tue Jun 13 05:26:20 CEST 2023


Hi,

I know how to calculate frequency dependent dielectric function of
materials (e.g, Au, Ag) by quantum espresso. But it  provides results at 0
K. If I want to find out the dielectric function at 300 K or other
temperatures, how do I do that? Can anybody give me directions that I can
follow? If I use the thermo_pw package in QE, is it possible to do that?

Thanks in advance for your time.

Best
Md Jahid Hasan
Mechanical Engineering
University of Maine
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