PSGen-1.6.0

 PSgen arguments: 
 -element Ti -xc PBE -smooth_v -bound l=0:rc=1.5 -bound l=1:rc=1.20
 -bound l=2:rc=1.2

 Bound state(s): 
   l=0: rc = 1.5
   l=1: rc = 1.2
   l=2: rc = 1.2

 Ti Z=22  [Ar] 3d2 4s2
 xc = PBE scalar relativistic core = yes
 mmax = 2000 rmin = 4.545e-08 rmax = 49.482
 total charge: 22.000

 Full atom solution:

 Weighted sum of eigenvalues:      -509.091248
 electron-nucleus energy:         -2029.244248
 Coulomb interaction energy:        356.848736
 Exc-Vxc:                            12.375524
 Total energy:                     -853.564459

  n     l     f     e[n,l]      r_peak
  -     -     -     ------      ------
  1     0  2.00 -178.928157    0.045346
  2     0  2.00  -19.732062    0.266109
  2     1  6.00  -16.326222    0.218357
  3     0  2.00   -2.301740    0.862777
  3     1  6.00   -1.428110    0.899459
  3     2  2.00   -0.156511    0.977568
  4     0  2.00   -0.164159    2.916217
 l=0 ic=149 rc: 1.500000
 l=1 ic=119 rc: 1.200000
 l=2 ic=119 rc: 1.200000
 dv: 8.944937
 eig: -0.164159 ae_eig: -0.164159 error: -1.076332e-08
 l = 0 ae_norm: 1.000001e+00
 l = 0 ps_norm: 1.000000e+00
 l=0 rctp=1.630000e+00
 r[icn]: 2.250000e+00
 ae_outnorm: 8.508461e-01
 ps_outnorm: 8.508909e-01
 dl = 1.915989e-03
 outnorm error after correction: -4.973799e-14
 dv: -2.804375e-01
 eig: -1.428110e+00 ae_eig: -1.428110e+00 error: -3.901257e-11
 l = 1 ae_norm: 1.000000e+00
 l = 1 ps_norm: 1.000000e+00
 l=1 rctp=4.000000e-01
 r[icn]: 1.800000e+00
 ae_outnorm: 6.995108e-02
 ps_outnorm: 6.888951e-02
 dl = -2.304454e-02
 outnorm error after correction: 4.959227e-13
 dv: -3.303936e+00
 eig: -1.565110e-01 ae_eig: -1.565110e-01 error: 2.530257e-09
 l = 2 ae_norm: 1.000000e+00
 l = 2 ps_norm: 1.000000e+00
 l=2 rctp=5.900000e-01
 r[icn]: 1.800000e+00
 ae_outnorm: 3.236440e-01
 ps_outnorm: 3.961600e-01
 dl = 7.363593e-01
 outnorm error after correction: 2.840631e-09
 integral of charge density: 1.000000e+01
 smooth_v
 matching v polynomial at r=7.500000e-01
 l=0 eigenvalue correction: -1.651083e-05
 matching v polynomial at r=6.000000e-01
 l=1 eigenvalue correction: 8.612340e-03
 matching v polynomial at r=6.000000e-01
 l=2 eigenvalue correction: 1.412735e-03

 bound states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=0                   -0.164159   -0.164086      7.237379e-05
 l=1                   -1.428110   -1.424012      4.097388e-03
 l=2                   -0.156511   -0.157529     -1.018154e-03
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=0         2.250      0.850846    0.850643      2.034110e-04
 l=1         1.800      0.069951    0.070598     -6.473673e-04
 l=2         1.800      0.323644    0.322412      1.231693e-03
 truncating v[l=0] at i = 1250
 truncating v[l=1] at i = 1250
 truncating v[l=2] at i = 1250