QEXSD_20.04.20 XML file generated by PWSCF This run was terminated on: 16:18:50 28 May 2025 32 1 1 1 1 32 scf from_scratch pwscf /usr/share/espresso/pseudo /var/www/html/data/material-modeling/Bi2Te3_mp-34202_primitive.cif-QuantumEspresso-bertran-20250528-160633 true true true low 10000000 1 5.000000000000000e-5 5.000000000000000e-4 5.000000000000000e-1 high 100000 2.089804000000000e2 Bi_pbe_v1.uspp.F.UPF 1.276000000000000e2 Te_pbe_v1.uspp.F.UPF 3.432873189796128e1 7.299472293995005e0 4.341410932605556e0 2.281505820535620e1 4.851268195618827e0 2.885324847218103e0 4.503822103266785e1 9.576679021290920e0 5.695795165397801e0 0.000000000000000e0 0.000000000000000e0 0.000000000000000e0 1.210556907064964e1 2.574061468322913e0 1.530940614614830e0 2.021379719233740e1 0.000000000000000e0 0.000000000000000e0 1.846499645547052e1 8.224445442241599e0 0.000000000000000e0 1.846499645547052e1 3.926295047410518e0 7.226735779941595e0 PBE false false false mp 0.000000000000000e0 smearing false 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