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<qes:espresso xsi:schemaLocation="http://www.quantum-espresso.org/ns/qes/qes-1.0 http://www.quantum-espresso.org/ns/qes/qes_030920.xsd" Units="Hartree atomic units" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xmlns:qes="http://www.quantum-espresso.org/ns/qes/qes-1.0">
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    <xml_format NAME="QEXSD" VERSION="20.04.20">QEXSD_20.04.20</xml_format>
    <creator NAME="PWSCF" VERSION="6.7MaX">XML file generated by PWSCF</creator>
    <created DATE=" 3Jun2026" TIME="10:49:15">This run was terminated on:  10:49:15   3 Jun 2026</created>
    <job></job>
  </general_info>
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    <nthreads>1</nthreads>
    <ntasks>1</ntasks>
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    <npool>8</npool>
    <ndiag>2</ndiag>
  </parallel_info>
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      <title></title>
      <calculation>scf</calculation>
      <restart_mode>from_scratch</restart_mode>
      <prefix>pwscf</prefix>
      <pseudo_dir>/usr/share/espresso/pseudo</pseudo_dir>
      <outdir>/var/lib/material-modelling/data/CdTe_1010536.cif-QuantumEspresso-iamat_farhi-20260603-101832</outdir>
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      <forces>true</forces>
      <wf_collect>true</wf_collect>
      <disk_io>low</disk_io>
      <max_seconds>10000000</max_seconds>
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      <forc_conv_thr>5.000000000000000e-4</forc_conv_thr>
      <press_conv_thr>5.000000000000000e-1</press_conv_thr>
      <verbosity>high</verbosity>
      <print_every>100000</print_every>
    </control_variables>
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        <pseudo_file>Cd.pbe-dn-rrkjus_psl.0.3.1.UPF</pseudo_file>
      </species>
      <species name="Te">
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        <pseudo_file>Te_pbe_v1.uspp.F.UPF</pseudo_file>
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  <closed DATE=" 3 Jun 2026" TIME="10:49:16"></closed>
</qes:espresso>
