File: Y_pbe_v1.uspp.F.UPF

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quantum-espresso-data-sssp 1.3.0-3
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<PP_INFO>
Generated using Vanderbilt code, version   7  3  6                              
Author: kfg        Generation date:   13    5 2013                              
Automatically converted from original format                                    
    1        The Pseudo was generated with a Scalar-Relativistic Calculation
  1.80000000000E+00    Local Potential cutoff radius
nl pn  l   occ               Rcut            Rcut US             E pseu
4S  4  0  2.00      0.00000000000      1.80000000000     -3.52742806400
4P  4  1  6.00      0.00000000000      2.00000000000     -2.05186430600
4D  4  2  1.00      0.00000000000      2.20000000000     -0.18491737900
5S  5  0  2.00      0.00000000000      1.80000000000     -0.30152453100
5P  5  1  0.00      0.00000000000      2.00000000000     -0.10588511000
</PP_INFO>


<PP_HEADER>
   0                   Version Number
  Y                    Element
   US                  Ultrasoft pseudopotential
    T                  Nonlinear Core Correction
SLA  PW   PBE  PBE     PBE  Exchange-Correlation functional
   11.00000000000      Z valence
  -87.16175192900      Total energy
    0.00000    0.00000 Suggested cutoff for wfc and rho
    2                  Max angular momentum component
  885                  Number of points in mesh
    5    6             Number of Wavefunctions, Number of Projectors
 Wavefunctions         nl  l   occ
                       4S  0  2.00
                       4P  1  6.00
                       4D  2  1.00
                       5S  0  2.00
                       5P  1  0.00
</PP_HEADER>


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  <PP_BETA>
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  9.19285226172E-01  9.41954957818E-01  9.64121415872E-01  9.85668101537E-01
  1.00647032691E+00  1.02639512154E+00  1.04530119898E+00  1.06303899400E+00
  1.07945078040E+00  1.09437088099E+00  1.10762598187E+00  1.11903556346E+00
  1.12841246208E+00  1.13556357577E+00  1.14029072900E+00  1.14239171060E+00
  1.14166150036E+00  1.13789369825E+00  1.13088217139E+00  1.12042293151E+00
  1.10631625649E+00  1.08836906579E+00  1.06639756017E+00  1.04023013074E+00
  1.00971054175E+00  9.74701385646E-01  9.35087805387E-01  8.90781472640E-01
  8.41724804746E-01  7.87895394820E-01  7.29310621183E-01  6.66032392800E-01
  5.98171974804E-01  5.25894827563E-01  4.49425376717E-01  3.69051618006E-01
  2.85129441945E-01  1.98086546007E-01  1.08425780382E-01  1.67277522664E-02
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 -4.24255683739E-03  2.37991126893E-04  0.00000000000E+00  0.00000000000E+00
  0.00000000000E+00  0.00000000000E+00  0.00000000000E+00
  </PP_BETA>
  <PP_DIJ>
    9                  Number of nonzero Dij
    1    1  6.23445611989E-01
    1    2 -1.34925541797E+00
    2    2 -1.66754832615E+00
    3    3  5.73199425931E+00
    3    4  5.61291949492E+00
    4    4  6.76630589587E+00
    5    5  1.01503230897E+01
    5    6 -1.23469749054E+01
    6    6  1.58605630525E+01
  </PP_DIJ>
  <PP_QIJ>
    6     nqf. If not zero, Qij's inside rinner are computed using qfcoef's
    <PP_RINNER>
    1  1.20000000000E+00
    2  1.20000000000E+00
    3  1.20000000000E+00
    4  1.20000000000E+00
    5  1.20000000000E+00
    </PP_RINNER>
    1    1    0        i  j  (l(j))
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4P    1  6.00          Wavefunction
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  0.00000000000E+00
</PP_RHOATOM>