PSGen-1.6.1

 PSgen arguments: 
 -element Ga -xc LDA -smooth_v -bound l=0:rc=1.15 -bound l=1:rc=1.30
 -bound l=2:rc=1.05

 Bound state(s): 
   l=0: rc = 1.15
   l=1: rc = 1.3
   l=2: rc = 1.05

 Ga Z=31  [Ar] 3d10 4s2 4p1
 xc = LDA scalar relativistic core = yes
 mmax = 2000 rmin = 3.226e-08 rmax = 49.474
 total charge: 31.000

 Full atom solution:

 Weighted sum of eigenvalues:     -1125.729886
 electron-nucleus energy:         -4680.822811
 Coulomb interaction energy:        838.944748
 Exc-Vxc:                            23.556342
 Total energy:                    -1941.118292

  n     l     f     e[n,l]      r_peak
  -     -     -     ------      ------
  1     0  2.00 -375.236109    0.031676
  2     0  2.00  -46.306518    0.181525
  2     1  6.00  -40.358625    0.145358
  3     0  2.00   -5.417921    0.563144
  3     1  6.00   -3.625427    0.563144
  3     2 10.00   -0.712960    0.528504
  4     0  2.00   -0.337135    1.881346
  4     1  1.00   -0.100605    2.503445
 l=0 ic=114 rc: 1.150000
 l=1 ic=129 rc: 1.300000
 l=2 ic=104 rc: 1.050000
 dv: 10.257135
 eig: -0.337135 ae_eig: -0.337135 error: -3.229459e-08
 l = 0 ae_norm: 1.000004e+00
 l = 0 ps_norm: 1.000000e+00
 l=0 rctp=9.300000e-01
 r[icn]: 1.730000e+00
 ae_outnorm: 7.299683e-01
 ps_outnorm: 6.945821e-01
 dl = -6.061694e-01
 outnorm error after correction: -2.163897e-10
 dv: 5.580424e+00
 eig: -1.006052e-01 ae_eig: -1.006052e-01 error: 8.197465e-10
 l = 1 ae_norm: 1.000000e+00
 l = 1 ps_norm: 1.000000e+00
 l=1 rctp=1.060000e+00
 r[icn]: 1.960000e+00
 ae_outnorm: 8.459395e-01
 ps_outnorm: 8.336529e-01
 dl = -3.837737e-01
 outnorm error after correction: -6.471779e-11
 dv: -8.445133e+00
 eig: -7.129604e-01 ae_eig: -7.129604e-01 error: 2.269498e-08
 l = 2 ae_norm: 1.000000e+00
 l = 2 ps_norm: 1.000000e+00
 l=2 rctp=4.700000e-01
 r[icn]: 1.580000e+00
 ae_outnorm: 6.502002e-02
 ps_outnorm: 1.379725e-01
 dl = 1.676758e+00
 outnorm error after correction: -5.198657e-09
 integral of charge density: 1.300000e+01
 smooth_v
 matching v polynomial at r=5.800000e-01
 l=0 eigenvalue correction: -7.120019e-06
 matching v polynomial at r=6.500000e-01
 l=1 eigenvalue correction: -3.758865e-06
 matching v polynomial at r=5.300000e-01
 l=2 eigenvalue correction: 1.466797e-03

 bound states test:
 eigenvalue test:          AE        pseudo           error
 ----------------          --        ------           -----
 l=0                   -0.337135   -0.337193     -5.770076e-05
 l=1                   -0.100605   -0.100613     -7.937038e-06
 l=2                   -0.712960   -0.712463      4.978796e-04
 norm test:   rcn          AE        pseudo           error
 ----------   ---          --        ------           -----
 l=0         1.730      0.729968    0.729870      9.794529e-05
 l=1         1.960      0.845940    0.845874      6.545489e-05
 l=2         1.580      0.065020    0.065091     -7.126878e-05
 truncating v[l=0] at i = 1033
 truncating v[l=1] at i = 1033
 truncating v[l=2] at i = 1033