PSGen-1.6.1

 PSgen arguments: 
 -element Xe -xc LDA -smooth_v -bound l=0:rc=1.00 -bound l=1:rc=1.20
 -scat l=2:rc=1.30

 Bound state(s): 
   l=0: rc = 1
   l=1: rc = 1.2
 Scattering state(s): 
   l=2: rc = 1.3, rmch = 3.25

 Xe Z=54  [Kr] 4d10 5s2 5p6
 xc = LDA scalar relativistic core = yes
 mmax = 2000 rmin = 1.852e-08 rmax = 49.460
 total charge: 54.000

 Full atom solution:

 Weighted sum of eigenvalues:     -4567.886392
 electron-nucleus energy:        -18016.814291
 Coulomb interaction energy:       2932.428701
 Exc-Vxc:                            58.952373
 Total energy:                    -7441.362720

  n     l     f     e[n,l]      r_peak
  -     -     -     ------      ------
  1     0  2.00-1261.819217    0.017098
  2     0  2.00 -196.416089    0.096103
  2     1  6.00 -176.338136    0.077343
  3     0  2.00  -40.158137    0.278531
  3     1  6.00  -33.673092    0.272548
  3     2 10.00  -24.029345    0.224161
  4     0  2.00   -7.239154    0.656769
  4     1  6.00   -5.182471    0.685923
  4     2 10.00   -2.184720    0.748171
  5     0  2.00   -0.734395    1.599922
  5     1  6.00   -0.308261    1.882930

 Energy of l=2 scattering state set to -0.308261
 l=0 ic=99 rc: 1.000000
 l=1 ic=119 rc: 1.200000
 l=2 ic=129 rc: 1.300000
 dv: 27.720567
 eig: -0.734395 ae_eig: -0.734395 error: 5.734695e-07
 l = 0 ae_norm: 1.000016e+00
 l = 0 ps_norm: 1.000000e+00
 l=0 rctp=9.800000e-01
 r[icn]: 1.500000e+00
 ae_outnorm: 7.080964e-01
 ps_outnorm: 6.892010e-01
 dl = -4.353085e-01
 outnorm error after correction: -2.180112e-11
 dv: 1.316625e+01
 eig: -3.082608e-01 ae_eig: -3.082608e-01 error: -3.061157e-08
 l = 1 ae_norm: 9.999992e-01
 l = 1 ps_norm: 1.000000e+00
 l=1 rctp=9.500000e-01
 r[icn]: 1.800000e+00
 ae_outnorm: 7.055139e-01
 ps_outnorm: 6.741313e-01
 dl = -5.995987e-01
 outnorm error after correction: 1.309541e-09
 rmch=3.250000e+00
 r[imch]=3.240000e+00
 u_scatt_ae[l=2] at rmch: 1.230507e+00
 u_scatt_pseudo[l=2] at imch: 1.230507e+00
 u_scatt_ae[l=2] at imch: 1.230507e+00
 l = 2 ae_scat_norm: 9.099791e-01
 l = 2 ps_scat_norm: 8.971948e-01
 dl = 1.477806e+00
 scatt_norm error after correction: -1.709945e-09
 integral of charge density: 8.000000e+00
 smooth_v
 matching v polynomial at r=5.000000e-01
 l=0 eigenvalue correction: 2.339387e-05
 matching v polynomial at r=6.000000e-01
 l=1 eigenvalue correction: -2.911624e-05
 matching v polynomial at r=6.500000e-01
 l=2 eigenvalue correction: -4.246033e-07

 bound states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=0                   -0.734395   -0.734339      5.597554e-05
 l=1                   -0.308261   -0.308267     -5.905422e-06
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=0         1.500      0.708096    0.708125     -2.844939e-05
 l=1         1.800      0.705514    0.705481      3.322008e-05

 scattering states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=2                   -0.308261   -0.308247      1.382160e-05
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=2         3.250      0.909979    0.909974      5.072858e-06
 truncating v[l=0] at i = 995
 truncating v[l=1] at i = 995
 truncating v[l=2] at i = 995