PSGen-1.6.1

 PSgen arguments: 
 -element As -xc LDA -smooth_v -bound l=0:rc=1.05 -bound l=1:rc=1.15
 -bound l=2:rc=0.95

 Bound state(s): 
   l=0: rc = 1.05
   l=1: rc = 1.15
   l=2: rc = 0.95

 As Z=33  [Ar] 3d10 4s2 4p3
 xc = LDA scalar relativistic core = yes
 mmax = 2000 rmin = 3.030e-08 rmax = 49.472
 total charge: 33.000

 Full atom solution:

 Weighted sum of eigenvalues:     -1316.288014
 electron-nucleus energy:         -5445.242061
 Coulomb interaction energy:        967.602983
 Exc-Vxc:                            26.140212
 Total energy:                    -2257.750785

  n     l     f     e[n,l]      r_peak
  -     -     -     ------      ------
  1     0  2.00 -429.922891    0.029706
  2     0  2.00  -54.548632    0.169311
  2     1  6.00  -47.883672    0.135488
  3     0  2.00   -6.963905    0.521448
  3     1  6.00   -4.902836    0.515944
  3     2 10.00   -1.502804    0.473950
  4     0  2.00   -0.540293    1.605971
  4     1  3.00   -0.196495    1.964734
 l=0 ic=104 rc: 1.050000
 l=1 ic=114 rc: 1.150000
 l=2 ic=94 rc: 0.950000
 dv: 12.952978
 eig: -0.540293 ae_eig: -0.540293 error: 2.463145e-09
 l = 0 ae_norm: 1.000007e+00
 l = 0 ps_norm: 1.000000e+00
 l=0 rctp=7.700000e-01
 r[icn]: 1.580000e+00
 ae_outnorm: 6.577386e-01
 ps_outnorm: 6.119127e-01
 dl = -6.482714e-01
 outnorm error after correction: 2.485953e-10
 dv: 7.986504e+00
 eig: -1.964950e-01 ae_eig: -1.964950e-01 error: 2.920670e-09
 l = 1 ae_norm: 9.999999e-01
 l = 1 ps_norm: 1.000000e+00
 l=1 rctp=8.700000e-01
 r[icn]: 1.730000e+00
 ae_outnorm: 7.728269e-01
 ps_outnorm: 7.535767e-01
 dl = -4.209880e-01
 outnorm error after correction: -4.218259e-11
 dv: -1.072897e+01
 eig: -1.502804e+00 ae_eig: -1.502804e+00 error: 2.308497e-08
 l = 2 ae_norm: 1.000000e+00
 l = 2 ps_norm: 1.000000e+00
 l=2 rctp=4.100000e-01
 r[icn]: 1.430000e+00
 ae_outnorm: 3.810558e-02
 ps_outnorm: 8.716735e-02
 dl = 1.681060e+00
 outnorm error after correction: -2.587891e-09
 integral of charge density: 1.500000e+01
 smooth_v
 matching v polynomial at r=5.300000e-01
 l=0 eigenvalue correction: -8.858471e-05
 matching v polynomial at r=5.800000e-01
 l=1 eigenvalue correction: -1.548820e-05
 matching v polynomial at r=4.800000e-01
 l=2 eigenvalue correction: 1.747098e-03

 bound states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=0                   -0.540293   -0.540384     -9.093532e-05
 l=1                   -0.196495   -0.196493      2.183963e-06
 l=2                   -1.502804   -1.501877      9.265767e-04
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=0         1.580      0.657739    0.657597      1.414861e-04
 l=1         1.730      0.772827    0.772782      4.517017e-05
 l=2         1.430      0.038106    0.038148     -4.240249e-05
 truncating v[l=0] at i = 996
 truncating v[l=1] at i = 996
 truncating v[l=2] at i = 996