TELLURIUM BASIS SETS FOR THE CRYSTAL PROGRAM
============================================

TCM CRYSTAL basis set library: https://vallico.net/mike_towler/crystal.html

Title:    Tellurium Te all-electron
Author:   M.D. Towler
When:     Nov 1995
Use:      Never used - optimization in atom only
Comment:  Remove outer diffuse Gaussian(s) and reoptimize valence functions 
          for crystals
Results:
                  TOTAL HF ENERGY   KINETIC ENERGY   VIRIAL THEOREM 
Te atom            -6611.6845966     6611.3684489    -2.0000478188        
(Roetti/Clementi)  -6611.7748        6611.6943       -2.0000122        
difference             0.0902034

Notes:
======
(1) Atomic energies refer to 5s2,4d10,5p4 (3P) configuration

Te atom
=======
THIS BASIS SET HAS BEEN DEVELOPED FOR THE FREE ATOM CASE AND SHOULD BE
CONSIDERED A *STARTING POINT* FOR SOLID-STATE CALCULATIONS. REMOVE
ANY DIFFUSE FUNCTIONS (EXPONENTS LESS THAN AROUND 0.1) AND REOPTIMIZE THE
REMAINING EXPONENTS/CONTRACTION COEFFICIENTS OF THE VALENCE FUNCTIONS IN
THE SITUATION OF INTEREST USING e.g. BILLY or LOPTCG. PLEASE SUMMARIZE
RESULTS to mdt26 at phy.cam.ac.uk
52 11
0 0 9 2.0 1.09163 
 3778640.0     0.0000487 
  560944.0     0.000389 
  121077.0     0.0022741 
   30953.9     0.011181 
    8947.9     0.0462 
    2853.46    0.1544 
    1011.5     0.3501 
     402.452   0.4287 
     169.156   0.1973 
0 1 7 8.0 1.1052 
   10835.9    -0.000224   0.00106 
    2517.28   -0.00592    0.00961 
     773.016  -0.0513     0.0569 
     274.759  -0.1472     0.2182 
     110.996   0.119      0.4564 
      51.689   0.5818     0.4451 
      25.1002  0.4643     0.2093 
0 1 6 8.0 1.12573 
     234.242   0.00686   -0.0133 
      92.42   -0.0281    -0.066 
      38.507  -0.3175     0.0118 
      17.4146 -0.0228     0.8318 
       8.0848  0.913      1.2962 
       3.8465  0.4354     0.4102 
0 3 6 10.0 1.0
     388.156   0.0134 
     115.656   0.0931 
      43.424   0.3012 
      17.9724  0.4717 
       7.8776  0.3119 
       3.2197  0.0502 
0 1 3 8.0 1.0
       8.1711 -4.6548    -0.0969 
       4.13235 0.7576     0.5867 
       1.8808 11.003      1.125 
0 1 1 6.0 1.0
       0.8629  1.0        1.0 
0 3 3 10.0 1.0
       6.3     0.2229 
       2.4953  0.5656 
       1.0077  0.4341 
0 3 1 0.0 1.0
       0.3797  1.0 
0 1 1 0.0 1.0
       0.4903  1.0        1.0 
0 1 1 0.0 1.0
       0.1854  1.0        1.0 
0 1 1 0.0 1.0
       0.0705  1.0        1.0