PSGen-1.6.0

 PSgen arguments: 
 -element Cr -xc PBE -smooth_v -bound l=0:rc=1.40 -bound l=1:rc=1.10
 -bound l=2:rc=1.3

 Bound state(s): 
   l=0: rc = 1.4
   l=1: rc = 1.1
   l=2: rc = 1.3

 Cr Z=24  [Ar] 3d5 4s1
 xc = PBE scalar relativistic core = yes
 mmax = 2000 rmin = 4.167e-08 rmax = 49.480
 total charge: 24.000

 Full atom solution:

 Weighted sum of eigenvalues:      -621.050147
 electron-nucleus energy:         -2506.970078
 Coulomb interaction energy:        443.888575
 Exc-Vxc:                            14.410764
 Total energy:                    -1050.527958

  n     l     f     e[n,l]      r_peak
  -     -     -     ------      ------
  1     0  2.00 -216.121521    0.041361
  2     0  2.00  -24.517178    0.241980
  2     1  6.00  -20.605302    0.196330
  3     0  2.00   -2.719141    0.772100
  3     1  6.00   -1.670012    0.796695
  3     2  5.00   -0.107063    0.839441
  4     0  1.00   -0.147269    2.735041
 l=0 ic=139 rc: 1.400000
 l=1 ic=109 rc: 1.100000
 l=2 ic=129 rc: 1.300000
 dv: 9.088106
 eig: -0.147269 ae_eig: -0.147269 error: 5.236658e-09
 l = 0 ae_norm: 1.000001e+00
 l = 0 ps_norm: 1.000000e+00
 l=0 rctp=1.490000e+00
 r[icn]: 2.100000e+00
 ae_outnorm: 8.594967e-01
 ps_outnorm: 8.547226e-01
 dl = -1.952525e-01
 outnorm error after correction: 4.010903e-12
 dv: -7.862963e-01
 eig: -1.670012e+00 ae_eig: -1.670012e+00 error: 8.149186e-10
 l = 1 ae_norm: 9.999999e-01
 l = 1 ps_norm: 1.000000e+00
 l=1 rctp=3.600000e-01
 r[icn]: 1.650000e+00
 ae_outnorm: 6.110842e-02
 ps_outnorm: 6.206889e-02
 dl = 2.276947e-02
 outnorm error after correction: 1.971062e-13
 dv: -3.961180e+00
 eig: -1.070626e-01 ae_eig: -1.070626e-01 error: -5.214237e-09
 l = 2 ae_norm: 1.000000e+00
 l = 2 ps_norm: 1.000000e+00
 l=2 rctp=6.100000e-01
 r[icn]: 1.960000e+00
 ae_outnorm: 2.370678e-01
 ps_outnorm: 3.405630e-01
 dl = 1.128291e+00
 outnorm error after correction: 7.749060e-09
 integral of charge density: 1.200000e+01
 smooth_v
 matching v polynomial at r=7.000000e-01
 l=0 eigenvalue correction: -1.171094e-05
 matching v polynomial at r=5.500000e-01
 l=1 eigenvalue correction: 1.029029e-02
 matching v polynomial at r=6.500000e-01
 l=2 eigenvalue correction: -6.123861e-04

 bound states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=0                   -0.147269   -0.146744      5.249490e-04
 l=1                   -1.670012   -1.661613      8.398850e-03
 l=2                   -0.107063   -0.107798     -7.351280e-04
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=0         2.100      0.859497    0.859857     -3.601704e-04
 l=1         1.650      0.061108    0.061824     -7.156039e-04
 l=2         1.960      0.237068    0.235433      1.635124e-03
 truncating v[l=0] at i = 3535
 truncating v[l=1] at i = 3535
 truncating v[l=2] at i = 3535