QEXSD_20.04.20 XML file generated by PWSCF This run was terminated on: 16: 3:14 2 Oct 2025 32 1 1 1 16 2 scf from_scratch pwscf /usr/share/espresso/pseudo /var/www/html/data/material-modeling/ReO3.cif-QuantumEspresso-rueff-20251002-160304 true true true low 10000000 1 5.000000000000000e-5 5.000000000000000e-4 5.000000000000000e-1 high 100000 1.862070000000000e2 Re_pbe_v1.2.uspp.F.UPF 1.599900000000000e1 O.pbe-n-kjpaw_psl.0.1.UPF 0.000000000000000e0 0.000000000000000e0 0.000000000000000e0 0.000000000000000e0 0.000000000000000e0 3.557554399947664e0 3.557554399947664e0 0.000000000000000e0 0.000000000000000e0 0.000000000000000e0 3.557554399947664e0 0.000000000000000e0 7.115108799895325e0 0.000000000000000e0 0.000000000000000e0 0.000000000000000e0 7.115108799895325e0 0.000000000000000e0 0.000000000000000e0 0.000000000000000e0 7.115108799895325e0 PBE false false false mp 0.000000000000000e0 smearing false 1.000000000000000e1 4.000000000000000e1 davidson plain 7.000000000000000e-1 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