PSGen-1.6.1

 PSgen arguments: 
 -element Hf -xc LDA -smooth_v -bound l=0:rc=1.6 -bound l=1:rc=1.25
 -bound l=2:rc=1.6

 Bound state(s): 
   l=0: rc = 1.6
   l=1: rc = 1.25
   l=2: rc = 1.6

 Hf Z=72  [Xe] 4f14 5d2 6s2
 xc = LDA scalar relativistic core = yes
 mmax = 2000 rmin = 1.389e-08 rmax = 49.453
 total charge: 72.000

 Full atom solution:

 Weighted sum of eigenvalues:     -9260.875984
 electron-nucleus energy:        -37185.954157
 Coulomb interaction energy:       5906.052332
 Exc-Vxc:                            97.722678
 Total energy:                   -15069.205638

  n     l     f     e[n,l]      r_peak
  -     -     -     ------      ------
  1     0  2.00-2397.239462    0.011813
  2     0  2.00 -410.015447    0.067933
  2     1  6.00 -360.154097    0.055118
  3     0  2.00  -93.402726    0.191085
  3     1  6.00  -78.509439    0.188994
  3     2 10.00  -60.852213    0.153342
  4     0  2.00  -18.792628    0.436101
  4     1  6.00  -13.904309    0.455721
  4     2 10.00   -7.587465    0.465860
  4     3 14.00   -0.625917    0.450735
  5     0  2.00   -2.468372    1.006297
  5     1  6.00   -1.312287    1.148323
  5     2  2.00   -0.105552    1.687716
  6     0  2.00   -0.193597    2.861875
 l=0 ic=159 rc: 1.600000
 l=1 ic=124 rc: 1.250000
 l=2 ic=159 rc: 1.600000
 dv: 9.746767
 eig: -0.193597 ae_eig: -0.193597 error: 4.938406e-09
 l = 0 ae_norm: 1.000002e+00
 l = 0 ps_norm: 1.000000e+00
 l=0 rctp=1.690000e+00
 r[icn]: 2.410000e+00
 ae_outnorm: 8.052892e-01
 ps_outnorm: 7.968735e-01
 dl = -2.861212e-01
 outnorm error after correction: -1.111774e-10
 dv: 4.326112e+00
 eig: -1.312287e+00 ae_eig: -1.312287e+00 error: 5.549741e-10
 l = 1 ae_norm: 9.999946e-01
 l = 1 ps_norm: 1.000000e+00
 l=1 rctp=4.400000e-01
 r[icn]: 1.880000e+00
 ae_outnorm: 1.290052e-01
 ps_outnorm: 9.208135e-02
 dl = -5.551364e-01
 outnorm error after correction: 5.437419e-10
 dv: 1.198179e-01
 eig: -1.055523e-01 ae_eig: -1.055523e-01 error: 4.594991e-11
 l = 2 ae_norm: 1.000000e+00
 l = 2 ps_norm: 1.000000e+00
 l=2 rctp=8.000000e-01
 r[icn]: 2.410000e+00
 ae_outnorm: 4.327172e-01
 ps_outnorm: 4.283149e-01
 dl = -4.349337e-02
 outnorm error after correction: 4.013123e-12
 integral of charge density: 1.000000e+01
 smooth_v
 matching v polynomial at r=8.000000e-01
 l=0 eigenvalue correction: 9.721783e-06
 matching v polynomial at r=6.300000e-01
 l=1 eigenvalue correction: -1.747267e-03
 matching v polynomial at r=8.000000e-01
 l=2 eigenvalue correction: 5.027820e-05

 bound states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=0                   -0.193597   -0.193652     -5.445482e-05
 l=1                   -1.312287   -1.313353     -1.066118e-03
 l=2                   -0.105552   -0.105387      1.658048e-04
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=0         2.410      0.805289    0.805341     -5.183748e-05
 l=1         1.880      0.129005    0.128715      2.905955e-04
 l=2         2.410      0.432717    0.433308     -5.908887e-04
 truncating v[l=0] at i = 828
 truncating v[l=1] at i = 828
 truncating v[l=2] at i = 828