[Wannier] Dipole correction in Wannier90

Stefan Velja stefan.velja at uni-oldenburg.de
Thu Jun 6 15:05:09 CEST 2024


Dear Wannier90 users and team,


I am working with a monolayer material which requires a dipole correction in Quantum ESPRESSO (with flags tefield and dipfield set to true). However, this does not seem to be compatible with Wannier90 and some of the obtained Wannier functions never get well localized. Is there a solution to this? How do you suggest I proceed?


Thank you very much in advance and kind regards,

Stefan Velja,

Carl von Ossietzky University of Oldenburg
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