SODIUM


Download for use in GAUSSIAN and COLUMBUS packages.

The following basis set and potential were taken from:


L.F. Pacios and P.A. Christiansen, J. Chem. Phys., 82, 2664 (1985).

Sodium Relativistic Effective Potential and Basis set including the 2s, 2p and 3s subshells in the valence space.


Basis Set
     Expn.      C(2s) 	   C(3s)      C(2p)

     15.68     -0.149359   0.024142
      1.836     0.631245  -0.118511
s     0.5784    0.502888  -0.165438
      0.3132   -0.038815  -0.056643
      0.07191   0.020798   0.438130
      0.02914  -0.008041   0.669026

     25.26                            0.077105
p     5.895                           0.318153
      1.706			      0.522194
      0.5024			      0.324191

Potential
     n    Expn.     C (AREP)       C (SO)

     2    2.478300  -14.538661
     2    3.099000   31.911208
s-p  2    3.947100  -32.322246
     1    8.216600    3.140947
     0    1.500800    1.877655
  
     2    1.606800   -0.000102    0.000086
p    2   22.523100   -1.715443    0.023508
     1   76.236500   -1.361911    0.032029