COPPER

Basis Set                                                                       
     Expn.       C                                                              
                                                                                
     2.449       0.010280                                                       
s    0.8596     -0.200289                                                       
     0.1192      0.512944                                                       
     0.04177     0.602319                                                       
                                                                                
    31.84        0.062762                                                       
     8.498       0.273012                                                       
d    2.684       0.443200                                                       
     0.9108      0.371371                                                       
     0.2890      0.231526                                                       
                                                                                
                                                                                
Potential                                                                       
    n         Exp.          Coef.
      d        
  5
    2        .475100        -.172871
    2       1.423700       -1.670338
    2       4.039600       -8.224877
    2      12.443900      -23.395144
    1      38.740400      -11.426145
     
      s-d         
  6
    2        .811500        6.229032
    2       1.107400      -48.317299
    2       1.380300      113.068708
    2       1.653800      -65.061849
    1       2.909400       19.981919
    0      10.474800        3.217010
     
      p-d         
  6
    2        .734700       35.695530
    2        .835900     -103.460066
    2       1.032300      151.972303
    2       1.253000      -87.702876
    1       2.321800       20.809243
    0       9.204200        4.792951
     
spin-orbit operator
     
      p-d         
  6
    2        .734700        1.084108
    2        .835900       -3.821542
    2       1.032300        7.315962
    2       1.253000       -5.182368
    1       2.321800         .036382
    0       9.204200        -.043062
     
      d        
  5
    2        .475100        -.002171
    2       1.423700         .003162
    2       4.039600         .009606
    2      12.443900        -.004260
    1      38.740400         .090928
     
Basis Set                                                                       
     Expn.     C (n=3)    C (n=4)                                               
                                                                                
              (-5.4122)  (-0.2899)                                              
s    64.63    -0.010798   0.002237                                              
     22.14     0.054887  -0.009846                                              
      9.347   -0.432320   0.102198                                              
      2.609    0.699674  -0.205952                                              
      0.9972   0.561074  -0.270595                                              
      0.1401   0.005981   0.614643                                              
      0.04936 -0.000816   0.519954                                              
                                                                                
              (-3.5999)                                                         
p    60.48    -0.012897                                                         
     25.36     0.000683                                                         
     11.17    -0.071092                                                         
      4.564    0.356761                                                         
      1.884    0.563904                                                         
      0.7347   0.227141                                                         
                                                                                
              (-0.7245)                                                         
d    53.65     0.027281                                                         
     15.07     0.147035                                                         
      5.104    0.362571                                                         
      1.727    0.467552                                                         
      0.5283   0.310915                                                         
      0.1491   0.054021                                                         
                                                                                
                                                                                
Potential                                                                       
    n         Exp.          Coef.
   d        
  4
    2      16.301600       -4.732275
    2      49.987600      -34.063556
    2     173.029700      -90.692245
    1     651.105600      -10.264608
     
      s-d         
  6
    2       3.708700      -87.139577
    2       4.512800      209.051201
    2       5.533800     -202.305237
    2      10.200600      154.841898
    1       2.660600        9.217435
    0      32.179300        3.188381
     
      p-d         
  6
    2       3.695000      -19.075190
    2       4.453800       63.056955
    2       6.176300     -127.180700
    2       8.839300      158.412136
    1      14.670300       -5.661282
    0      30.433500        5.398826
     
spin-orbit operator
     
      p-d         
  6
    2       3.695000        -.604602
    2       4.453800        2.245388
    2       6.176300       -5.454358
    2       8.839300        8.174906
    1      14.670300       -1.483716
    0      30.433500         .073914
     
   d        
  4
    2      16.301600         .063509
    2      49.987600         .272004
    2     173.029700        1.908336
    1     651.105600        1.591675