  US Au
 11.0000000000000000
 parameters from PSCTR are:
   VRHFIN =Au: s1d10
   LEXCH  = CA
   EATOM  =  1353.1269 eV,   99.4520 Ry
   GGA    =   -10.2321   -8.5625    3.7153   -8.9646 eV

   TITEL  = US Au
   LULTRA =        T    use ultrasoft PP ?
   IUNSCR =        1    unscreen: 0-lin 1-nonlin 2-no
   RPACOR =   -1.000    partial core radius
   POMASS =  196.966; ZVAL   =   11.000    mass and valenz
   RCORE  =    2.840    outmost cutoff radius
   RWIGS  =    2.840; RWIGS  =    1.503    wigner-seitz radius (au A)
   ENMAX  =  179.692; ENMIN  =  134.769 eV
   EAUG   =  303.006

   RCLOC  =    1.964    cutoff for local pot
   LCOR   =        T    correct aug charges
   RMAX   =    3.440    core radius for proj-oper
   QCUT   =   -3.634; QGAM   =    7.268    optimization parameters

   Description
     l     E      TYP  RCUT    TYP  RCUT
     2   .000      7  2.300    23  2.840
     2   .000      7  2.300    23  2.840
     0   .000     15  2.530    23  2.530
     0   .000     15  2.530    23  2.530
     1  -.200     15  2.530    23  2.840
     1   .000     15  2.530    23  2.840
     3   .000      7   .000     0   .000
   Error from kinetic energy argument (eV)
   NDATA  =      100
   STEP   =   20.000   1.050
  127.      124.      122.      119.      118.      114.      110.      109.
  105.      101.      98.5      94.3      89.9      85.6      81.1      76.7
  72.3      67.9      63.6      57.2      53.1      49.1      43.4      39.8
  36.3      31.4      27.0      24.2      20.4      17.0      14.1      11.5
  9.25      7.35      5.76      4.45      3.07      2.27      1.48      1.04
  .629      .364      .204      .114      .684E-01  .491E-01  .431E-01  .422E-01
  .417E-01  .387E-01  .329E-01  .272E-01  .199E-01  .136E-01  .825E-02  .573E-02
  .456E-02  .418E-02  .415E-02  .397E-02  .348E-02  .277E-02  .202E-02  .134E-02
  .998E-03  .839E-03  .816E-03  .798E-03  .702E-03  .561E-03  .396E-03  .284E-03
  .238E-03  .231E-03  .221E-03  .192E-03  .145E-03  .105E-03  .857E-04  .824E-04
  .777E-04  .642E-04  .482E-04  .376E-04  .349E-04  .328E-04  .272E-04  .204E-04
  .172E-04  .164E-04  .143E-04  .111E-04  .904E-05  .861E-05  .753E-05  .580E-05
  .495E-05  .476E-05  .388E-05  .305E-05
END of PSCTR-controll parameters
 local part
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 Non local Part
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 21.1038130485608910 0.680107810350520703 0.680107810350520703 -15.9630470503529249
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 Real Space Part
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 Non local Part
 0 2 1.82015698791642544
 2.10850674595916665 -7.42498025883079382 -7.42498025883079382 28.8198887218479776
 Reciprocal Space Part
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 Real Space Part
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 Reciprocal Space Part
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 Real Space Part
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 Augmentation charge
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 Augmentation charge
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 Augmentation charge
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 End of Dataset
