PSGen-1.6.0

 PSgen arguments: 
 -element Li -xc PBE -smooth_v -bound l=0:rc=2.2 -scat l=1:rc=2.0

 Bound state(s): 
   l=0: rc = 2.2
 Scattering state(s): 
   l=1: rc = 2, rmch = 5

 Li Z=3  1s2 2s1
 xc = PBE scalar relativistic core = yes
 mmax = 2000 rmin = 3.333e-07 rmax = 49.532
 total charge: 3.000

 Full atom solution:

 Weighted sum of eigenvalues:        -3.916874
 electron-nucleus energy:           -17.101686
 Coulomb interaction energy:          4.032245
 Exc-Vxc:                             0.496920
 Total energy:                       -7.452198

  n     l     f     e[n,l]      r_peak
  -     -     -     ------      ------
  1     0  2.00   -1.905625    0.360441
  2     0  1.00   -0.105624    3.111692

 Energy of l=1 scattering state set to -0.105624
 l=0 ic=219 rc: 2.200000
 l=1 ic=199 rc: 2.000000
 dv: 0.492852
 eig: -0.105624 ae_eig: -0.105624 error: -1.443831e-11
 l = 0 ae_norm: 1.000000e+00
 l = 0 ps_norm: 1.000000e+00
 l=0 rctp=8.000000e-01
 r[icn]: 3.300000e+00
 ae_outnorm: 5.911357e-01
 ps_outnorm: 5.648290e-01
 dl = -2.685276e-01
 outnorm error after correction: -5.782586e-11
 rmch=5.000000e+00
 r[imch]=4.990000e+00
 u_scatt_ae[l=1] at rmch: 7.358633e-01
 u_scatt_pseudo[l=1] at imch: 7.358633e-01
 u_scatt_ae[l=1] at imch: 7.358633e-01
 l = 1 ae_scat_norm: 9.636644e-01
 l = 1 ps_scat_norm: 9.369312e-01
 dl = 4.758350e-01
 scatt_norm error after correction: -1.528579e-10
 integral of charge density: 1.000000e+00
 smooth_v
 matching v polynomial at r=1.100000e+00
 l=0 eigenvalue correction: -1.824156e-05
 matching v polynomial at r=1.000000e+00
 l=1 eigenvalue correction: -1.812399e-06

 bound states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=0                   -0.105624   -0.105632     -7.322013e-06
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=0         3.300      0.591136    0.591022      1.133634e-04

 scattering states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=1                   -0.105624   -0.105612      1.198409e-05
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=1         5.000      0.963664    0.963689     -2.436470e-05
 truncating v[l=0] at i = 3858
 truncating v[l=1] at i = 3858