PSGen-1.6.1

 PSgen arguments: 
 -element Zn -xc LDA -smooth_v -bound l=0:rc=1.10 -bound l=1:rc=0.90
 -bound l=2:rc=1.00

 Bound state(s): 
   l=0: rc = 1.1
   l=1: rc = 0.9
   l=2: rc = 1

 Zn Z=30  [Ar] 3d10 4s2
 xc = LDA scalar relativistic core = yes
 mmax = 2000 rmin = 3.333e-08 rmax = 49.475
 total charge: 30.000

 Full atom solution:

 Weighted sum of eigenvalues:     -1037.105441
 electron-nucleus energy:         -4324.210293
 Coulomb interaction energy:        778.510742
 Exc-Vxc:                            22.300026
 Total energy:                    -1793.316157

  n     l     f     e[n,l]      r_peak
  -     -     -     ------      ------
  1     0  2.00 -349.384195    0.032724
  2     0  2.00  -42.488899    0.189009
  2     1  6.00  -36.876588    0.151402
  3     0  2.00   -4.726861    0.585333
  3     1  6.00   -3.059764    0.591549
  3     2 10.00   -0.382989    0.561113
  4     0  2.00   -0.228768    2.057691
 l=0 ic=109 rc: 1.100000
 l=1 ic=89 rc: 0.900000
 l=2 ic=99 rc: 1.000000
 dv: 13.370030
 eig: -0.228768 ae_eig: -0.228768 error: -9.871617e-10
 l = 0 ae_norm: 1.000003e+00
 l = 0 ps_norm: 1.000000e+00
 l=0 rctp=1.120000e+00
 r[icn]: 1.650000e+00
 ae_outnorm: 8.392623e-01
 ps_outnorm: 8.281929e-01
 dl = -3.623091e-01
 outnorm error after correction: -5.663836e-11
 dv: -3.208814e+00
 eig: -3.059764e+00 ae_eig: -3.059764e+00 error: 1.815957e-09
 l = 1 ae_norm: 9.999994e-01
 l = 1 ps_norm: 1.000000e+00
 l=1 rctp=2.800000e-01
 r[icn]: 1.350000e+00
 ae_outnorm: 3.436704e-02
 ps_outnorm: 3.906469e-02
 dl = 1.715392e-01
 outnorm error after correction: -5.966061e-14
 dv: -8.052996e+00
 eig: -3.829887e-01 ae_eig: -3.829887e-01 error: -9.825308e-09
 l = 2 ae_norm: 1.000000e+00
 l = 2 ps_norm: 1.000000e+00
 l=2 rctp=4.600000e-01
 r[icn]: 1.500000e+00
 ae_outnorm: 1.248480e-01
 ps_outnorm: 2.177470e-01
 dl = 1.396023e+00
 outnorm error after correction: 5.461087e-09
 integral of charge density: 1.800000e+01
 smooth_v
 matching v polynomial at r=5.500000e-01
 l=0 eigenvalue correction: -1.985278e-06
 matching v polynomial at r=4.500000e-01
 l=1 eigenvalue correction: 2.073513e-03
 matching v polynomial at r=5.000000e-01
 l=2 eigenvalue correction: -1.758090e-04

 bound states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=0                   -0.228768   -0.228733      3.444489e-05
 l=1                   -3.059764   -3.057835      1.929134e-03
 l=2                   -0.382989   -0.383209     -2.203809e-04
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=0         1.650      0.839262    0.839290     -2.794896e-05
 l=1         1.350      0.034367    0.034425     -5.792605e-05
 l=2         1.500      0.124848    0.124770      7.824037e-05
 truncating v[l=0] at i = 549
 truncating v[l=1] at i = 549
 truncating v[l=2] at i = 549