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  <attribution id="A8">
    <name>Fredric GRANBERG</name>
    <affiliation>Department of Physics, University of Helsinki</affiliation>
    <doi>10.1140/epjb/e2019-100240-3</doi>
    <acknowledgements>Acknowledgement: This work has been carried out within the framework of the EUROfusion Consortium and has received funding from the Euratom research and training programme 2014 - 2018 and 2019 - 2020 under grant agreement No 633053. The views and opinions expressed herein do not necessarily reflect those of the European Commission. Computer time granted by the IT Center for Science - CSC - Finland and the Finnish Grid and Cloud Infrastructure (persistent identifier urn:nbn:fi:research-infras-2016072533) are gratefully acknowledged.</acknowledgements>
  </attribution>
  <material>
    <formula>Fe</formula>
    <structure>bcc</structure>
    <lattice_parameters>
      <a units="Å">2.855300</a>
      <b units="Å">2.855300</b>
      <c units="Å">2.855300</c>
      <alpha units="deg">90.000000</alpha>
      <beta units="deg">90.000000</beta>
      <gamma units="deg">90.000000</gamma>
    </lattice_parameters>
  </material>
  <has_surface>false</has_surface>
  <initially_perfect>true</initially_perfect>
  <PKA_atomic_number>26</PKA_atomic_number>
  <PKA>
    <energy units="keV">10.000000</energy>
    <recoil>true</recoil>
  </PKA>
  <electronic_stopping>true</electronic_stopping>
  <electronic_stopping_comment>for all atoms with K.E. &gt; 1 eV</electronic_stopping_comment>
  <thermostat>true</thermostat>
  <thermostat_comment>border cooling, 0K</thermostat_comment>
  <simulation_time units="ps">30.000</simulation_time>
  <initial_temperature units="K">0.00</initial_temperature>
  <simulation_box>
    <box_X_length units="Å">171.3187</box_X_length>
    <box_Y_length units="Å">179.8846</box_Y_length>
    <box_Z_length units="Å">188.4506</box_Z_length>
    <box_orientation>
      <X_orientation>100</X_orientation>
      <Y_orientation>010</Y_orientation>
      <Z_orientation>001</Z_orientation>
    </box_orientation>
  </simulation_box>
  <interatomic_potential>
    <uri>https://cascadesdb.org/potential/4</uri>
    <doi>10.1088/0953-8984/16/27/003</doi>
  </interatomic_potential>
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    <name>PARCAS</name>
    <version>5.05</version>
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  <data>
    <archive_name>05e-A04-0K-10keV-M.tar.gz</archive_name>
    <comments>Medium damage</comments>
  </data>
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