QEXSD_20.04.20 XML file generated by PWSCF This run was terminated on: 16:48:32 3 Oct 2023 8 1 1 1 1 8 scf from_scratch pwscf /usr/share/espresso/pseudo /var/www/html/data/material_modeling/Ge_mp-32_computed.cif-QuantumEspresso-com-ailes-20231003-164652/ true true true low 10000000 1 5.000000000000000e-5 5.000000000000000e-4 5.000000000000000e-1 high 100000 7.263000000000000e1 ge_pbe_v1.4.uspp.F.UPF 7.700556101133679e0 4.445918137867911e0 3.143738863888723e0 1.155083415170052e1 6.668877206896352e0 4.715608295833084e0 7.700556101133679e0 0.000000000000000e0 0.000000000000000e0 3.850278050566839e0 6.668877206849014e0 0.000000000000000e0 3.850278050566839e0 2.222959068949677e0 6.287477727817791e0 PBE false false false mp 0.000000000000000e0 smearing false 5.000000000000000e0 2.000000000000000e1 davidson plain 7.000000000000000e-1 5.000000000000000e-6 8 100 false false false false 0.000000000000000e0 false 20 20 Monkhorst-Pack none 1.000000000000000e2 false false none 0.000000000000000e0 1.452600000000000e2 0.000000000000000e0 false false false false false false false false false

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