* Titanium
  Z = 22  Z_val = 10

* Units: Hartrees

* Core radii

  l value                 core radii (au)
  -------                 ---------------
     s                         2.39   
     p                         1.39   
     d                         1.39   

* Localisation radii, (r_loc, |V_l - V_l'|<10^-5 for r>r_loc and all l,l')

  Pseudopotential Type       r_loc (au)
  --------------------      -----------
  Localised (Grid)             2.81   
  Parameterised (Gaussians)    3.38   


* Eigenvalues of the 3p(6)3d(2)4s(2) state

                LS Coupling [3F]             jj Coupling [AV] 
  l value    All-el HF    Pseudo HF       All-el DF    Pseudo HF
  -------    ---------    ---------       ---------    ---------
     s       -0.22079     -0.22252        -0.22369     -0.22367
     p       -1.79509     -1.79650        -1.80559     -1.80554
     d       -0.44066     -0.43181        -0.39560     -0.39553

  (All-electron DF eigenvalues are averaged over spin)


* Energy terms of the Pseudo HF (LS) 3p(6)3d(2)4s(2) [3F] state

  kinetic energy            =            21.58730
  el-ion interaction energy =           -84.65016
                    (s part =           -5.91425)
                    (p part =           -60.44107)
                    (d part =           -18.29484)
  Hartree energy            =            29.25506
  exchange energy           =           -3.76747
  -------------------------------------------------
  total energy              =           -37.57527


* Excitation Energies

  Configuration             LS Coupling                    jj Coupling    
                        All-el HF     Pseudo HF        All-el DF     Pseudo HF
                   Term  Energy        Energy     Term  Energy        Energy
                   ----  ------        ------     ----  ------        ------
  3p(6)3d(2)4s(2)   3F   0.00000       0.00000     AV   0.00000       0.00000
  3p(6)3d(3)4s(1)   5F   0.02505       0.02299     AV   0.06422       0.06631
  3p(6)3d(4)        5D   0.16459       0.17157     AV   0.20092       0.20714
  3p(6)3d(2)4s(1)   4F   0.20374       0.19983     AV   0.21458       0.21464
  3p(6)3d(3)        4F   0.22679       0.23261     AV   0.25564       0.26121

  The All-el HF results have been corrected for relativistic effects
  by including mass-velocity, Darwin, and spin-spin contact terms.