Atom = Mn  Z =   25
 Perdew - Burke - Ernzerhof GGA
Log grid -- n,r0,rmax =  2001  2.5326229E-04  8.0000000E+01
 Non-relativistic calculation
  all-electron results 
  core states (zcore) =    10.0000000000000     
    1    1    0  2.0000000E+00 -4.6847251E+02
    2    2    0  2.0000000E+00 -5.3857274E+01
    5    2    1  6.0000000E+00 -4.6163941E+01
  valence states (zvale) =    15.0000000000000     
    3    3    0  2.0000000E+00 -6.1875020E+00
    4    4    0  2.0000000E+00 -3.6963030E-01
    6    3    1  6.0000000E+00 -3.9900147E+00
    7    4    1  0.0000000E+00 -1.0240423E-01
    8    3    2  5.0000000E+00 -5.1520417E-01
 evale =   -284.519786389018     
 selfenergy contribution =    12.5459311430486     
  paw parameters: 
       lmax =            2
         rc =    1.90842495894068     
        irc =         1411
 Vloc: Norm-conserving Troullier-Martins form; l= 3;e=   0.0000E+00
 Projector method: Vanderbilt (polynomial pseudization)
 Sinc^2 compensation charge shape zeroed at rc

Number of basis functions     6
 No.   n    l      Energy         Cp coeff         Occ
    1    3    0 -6.1875020E+00  9.6999404E-01  2.0000000E+00
    2    4    0 -3.6963030E-01 -4.2033906E-01  2.0000000E+00
    3    3    1 -3.9900147E+00  6.4957577E+00  6.0000000E+00
    4    4    1 -1.0240423E-01  3.3950763E+02  0.0000000E+00
    5    3    2 -5.1520417E-01  7.1334944E+01  5.0000000E+00
    6  999    2  2.0000000E+00  9.6479717E+01  0.0000000E+00
evale from matrix elements -2.84519786323814571E+02