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Dear all,</div>
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I am writing to follow up on the issue I previously reported. I am still awaiting a response regarding this problem, which persists consistently. Additionally, I want to mention that this issue occurs exclusively with GGA+U and not with GGA.<br>
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<div id="divRplyFwdMsg" dir="ltr"><font face="Calibri, sans-serif" style="font-size:11pt" color="#000000"><b>From:</b> users <users-bounces@lists.quantum-espresso.org> on behalf of NAIMI SALMA <salma_naimi@um5.ac.ma><br>
<b>Sent:</b> Sunday, June 30, 2024 3:47 PM<br>
<b>To:</b> users@lists.quantum-espresso.org <users@lists.quantum-espresso.org><br>
<b>Subject:</b> [QE-users] Issue with NiO Band Structure Alignment Using Hubbard Correction</font>
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I want to plot the band structure of AFM NiO with and without the Hubbard correction. When I added the Hubbard correction, I plotted E-Efermi, but the valence band maximum is below 0 eV (around -1.8 eV). I don't know how to correct this to align it with 0
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I attached just the scf.in file (for the nscf file I added just the nbnd and for band.in I added nband and changed the the k-points to crystal_b)</div>
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Could you please guide me on what might be the issue?</div>
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Salma NAIMI</div>
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Mohammed 5 University</div>
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