PSGen-1.6.1

 PSgen arguments: 
 -element Cs -xc LDA -smooth_v -bound l=0:rc=2.50 -bound l=1:rc=2.00
 -scat l=2:rc=2.00

 Bound state(s): 
   l=0: rc = 2.5
   l=1: rc = 2
 Scattering state(s): 
   l=2: rc = 2, rmch = 5

 Cs Z=55  [Xe] 6s1
 xc = LDA scalar relativistic core = yes
 mmax = 2000 rmin = 1.818e-08 rmax = 49.460
 total charge: 55.000

 Full atom solution:

 Weighted sum of eigenvalues:     -4797.392746
 electron-nucleus energy:        -18835.284554
 Coulomb interaction energy:       3044.123030
 Exc-Vxc:                            60.681370
 Total energy:                    -7780.834406

  n     l     f     e[n,l]      r_peak
  -     -     -     ------      ------
  1     0  2.00-1314.215508    0.016618
  2     0  2.00 -206.186545    0.094563
  2     1  6.00 -185.057481    0.076090
  3     0  2.00  -42.847328    0.271350
  3     1  6.00  -36.047231    0.265516
  3     2 10.00  -26.038372    0.218342
  4     0  2.00   -8.074621    0.640300
  4     1  6.00   -5.897715    0.668748
  4     2 10.00   -2.728769    0.713806
  5     0  2.00   -0.988385    1.527415
  5     1  6.00   -0.500028    1.759190
  6     0  1.00   -0.081835    4.627677

 Energy of l=2 scattering state set to -0.081835
 l=0 ic=249 rc: 2.500000
 l=1 ic=199 rc: 2.000000
 l=2 ic=199 rc: 2.000000
 dv: 3.683608
 eig: -0.081835 ae_eig: -0.081835 error: -1.100834e-09
 l = 0 ae_norm: 1.000001e+00
 l = 0 ps_norm: 1.000000e+00
 l=0 rctp=2.660000e+00
 r[icn]: 3.750000e+00
 ae_outnorm: 8.283194e-01
 ps_outnorm: 8.205270e-01
 dl = -2.837612e-01
 outnorm error after correction: -4.058864e-12
 dv: 1.227247e+00
 eig: -5.000278e-01 ae_eig: -5.000278e-01 error: 4.043825e-10
 l = 1 ae_norm: 9.999989e-01
 l = 1 ps_norm: 1.000000e+00
 l=1 rctp=6.800000e-01
 r[icn]: 3.000000e+00
 ae_outnorm: 1.175267e-01
 ps_outnorm: 8.824436e-02
 dl = -4.577562e-01
 outnorm error after correction: 1.651705e-10
 rmch=5.000000e+00
 r[imch]=4.990000e+00
 u_scatt_ae[l=2] at rmch: 7.311989e-01
 u_scatt_pseudo[l=2] at imch: 7.311989e-01
 u_scatt_ae[l=2] at imch: 7.311989e-01
 l = 2 ae_scat_norm: 9.514520e-01
 l = 2 ps_scat_norm: 9.614430e-01
 dl = -1.388300e-01
 scatt_norm error after correction: -4.777956e-12
 integral of charge density: 7.000000e+00
 smooth_v
 matching v polynomial at r=1.250000e+00
 l=0 eigenvalue correction: 5.425560e-06
 matching v polynomial at r=1.000000e+00
 l=1 eigenvalue correction: -2.534767e-04
 matching v polynomial at r=1.000000e+00
 l=2 eigenvalue correction: 4.277263e-06

 bound states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=0                   -0.081835   -0.081826      9.625428e-06
 l=1                   -0.500028   -0.500079     -5.161942e-05
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=0         3.750      0.828319    0.828418     -9.886809e-05
 l=1         3.000      0.117527    0.117459      6.815017e-05

 scattering states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=2                   -0.081835   -0.081791      4.402005e-05
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=2         5.000      0.951452    0.951172      2.799155e-04
 truncating v[l=0] at i = 3999
 truncating v[l=1] at i = 3999
 truncating v[l=2] at i = 3999