THALLIUM

Basis Set                                                                       
     Expn.       C                                                              
                                                                                
     0.5323     -0.788045                                                       
s    0.3023      0.895707                                                       
     0.0964      0.670993                                                       
     0.0370      0.096444                                                       
                                                                                
     0.7128     -0.098163                                                       
     0.2248      0.245497                                                       
p    0.0994      0.442528                                                       
     0.0459      0.373123                                                       
     0.0213      0.099656                                                       
                                                                                
     9.9370     -0.018464                                                       
     1.6752      0.454165                                                       
d    0.7170      0.457592                                                       
     0.3090      0.216318                                                       
     0.1276      0.038044                                                       
                                                                                
f    0.9126      1.000000                                                       
                                                                                
                                                                                
Potential                                                                       
    n         Exp.          Coef.
      g           
  6
    2       1.188500       -1.305280
    2       2.826400      -11.615490
    2       8.247200      -44.717980
    2      20.529000     -130.115524
    2      70.763200     -340.590473
    1     223.323400      -53.444254
     
         s-g         
  7
    2        .985000       44.021089
    2       1.135800     -142.719578
    2       1.489600      282.763667
    2       2.107900     -306.241150
    2       2.925500      186.004451
    1      10.644300       55.996380
    0      34.876400        6.371788
     
         p-g            
  8
    2        .290400         .115591
    2        .920100      -54.439704
    2       1.084500      175.902403
    2       1.430100     -220.556211
    2       1.989300      204.958085
    2       2.780900     -130.962041
    1       2.842100       45.825781
    0      11.049000        5.996205
     
         d-g            
  8
    2        .432300        -.218699
    2       1.632300      -29.019674
    2       1.959400       86.319069
    2       2.657300     -154.261861
    2       3.919600      263.326014
    2       5.707100     -188.003359
    1       9.006300       66.478281
    0      45.861500        6.709649
     
         f-g            
  8
    2        .597400       19.797970
    2        .679300      -62.511195
    2        .860600      116.891258
    2       1.185700     -202.106483
    2       1.719400      274.155344
    2       2.387800     -150.327522
    1       3.857300       49.980030
    0      13.488900        9.284637
     
spin-orbit operator
     
         p-g            
  8
    2        .290400         .011998
    2        .920100      -15.887332
    2       1.084500       62.388680
    2       1.430100      -97.567302
    2       1.989300       77.922050
    2       2.780900      -34.032450
    1       2.842100        -.904480
    0      11.049000        -.295330
     
         d-g            
  8
    2        .432300        -.037005
    2       1.632300        4.031599
    2       1.959400       -9.421223
    2       2.657300        8.472723
    2       3.919600        1.512927
    2       5.707100       -7.754193
    1       9.006300         .432276
    0      45.861500        -.060172
     
         f-g            
  8
    2        .597400        -.154263
    2        .679300         .474888
    2        .860600        -.825680
    2       1.185700        1.122090
    2       1.719400        -.989723
    2       2.387800         .336488
    1       3.857300         .007931
    0      13.488900         .000568
     
      g           
  6
    2       1.188500        -.020081
    2       2.826400         .052528
    2       8.247200        -.104978
    2      20.529000         .432037
    2      70.763200         .241122
    1     223.323400        1.513462
