quantum-espresso-data 5.0-1 / usr / share / espresso / pseudo / Cu.pbe-kjpaw.UPF

<UPF version="2.0.0">
  <PP_INFO>
    Generated using "atomic" code by A. Dal Corso (espresso distribution)
    Author: "Lorenzo Paulatto" /paulatto@sissa.it/
    Generation date: 15Apr2008
    Pseudopotential type: PAW
    Element: Cu
    Functional:  SLA  PW   PBX  PBC

    Suggested minimum cutoff for wavefunctions:  47. Ry
    Suggested minimum cutoff for charge density: 189. Ry
    The Pseudo was generated with a Scalar-Relativistic Calculation
    L component and cutoff radius for Local Potential:  1   2.2000

    Valence configuration: 
    nl pn  l   occ       Rcut    Rcut US       E pseu
    3D  3  2 10.00      2.000      2.100    -0.370325
    4S  1  0  1.00      2.000      2.100    -0.338808
    4P  2  1  0.00      2.000      2.300    -0.051247
  </PP_INFO>
  <!--                               -->
  <!-- END OF HUMAN READABLE SECTION -->
  <!--                               -->
  <PP_HEADER generated='Generated using "atomic" code by A. Dal Corso (espresso distribution)'
             author='"Lorenzo Paulatto" &lt;paulatto@sissa.it&gt;'
             date="15Apr2008"
             comment=""
             element="Cu"
             pseudo_type="PAW"
             relativistic="scalar"
             is_ultrasoft="T"
             is_paw="T"
             is_coulomb="F"
             has_so="F"
             has_wfc="T"
             has_gipaw="F"
             core_correction="T"
             functional=" SLA  PW   PBX  PBC "
             z_valence="1.100000000000000E+001"
             total_psenergy="-2.129443437976441E+002"
             wfc_cutoff="4.722276349186907E+001"
             rho_cutoff="1.888910539674763E+002"
             l_max="2"
             l_max_rho="4"
             l_local="1"
             mesh_size="1199"
             number_of_wfc="3"
             number_of_proj="6"/>
  <PP_MESH dx="1.250000000000000E-002" mesh="1199" xmin="-7.000000000000000E+000" rmax="1.000000000000000E+002"
zmesh="2.900000000000000E+001">
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