[QE-users] error message: wrong offset

Adrian Popescu elementh11 at gmail.com
Tue May 12 17:55:05 CEST 2020


Hello,

I am trying to run a scf calculation for europium with spin-orbit coupling
and LDA+U and I get the following error:
from offset_atom_wfc: error #
wrong offset
I see from the archived posts that this may be caused by the
pseudopotential not containing the wave functions information. However, the
pseudopotential I am using (from the Quantum Espresso web page PSLibrary)
contains this information and has_wfc = .true.
Any ideas on how to get over this issue?
Thank you,

Adrian Popescu
Postdoctoral researcher
University of South Florida
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