Band ordering in GW eigenvalues

Please post here any issue related to convergence parameters in linear response GW and BSE calculations.

Moderators: Davide Sangalli, Daniele Varsano

ivona
Posts: 9
Joined: Mon Sep 16, 2019 5:35 pm

Re: Band ordering in GW eigenvalues

Post by ivona » Thu Jul 23, 2020 5:10 pm

Dear Daniele,

thanks for this. I am glad to hear that I am not making a fundamental mistake in the GW calculation. I will go through the interpolation again and I
will redo the convergence tests for the given k-points and the bands explicitly. I will keep you posted!

Best,
Ivona
Ivona Bravic
Theory of Condensed Matter Group
University of Cambridge

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