MOLPRO Basis Query, element=Au, basis=ECP60MDF_WCVTZ, l=d
Basis Au d ECP60MDF_WCVTZ
Primitives | Contractions... |
87.020800 | 0.000044 | -0.000031 | -0.000044 | 0.000000 | 0.000000 | 0.000000 |
11.066800 | 0.014288 | -0.019959 | 0.035083 | 0.000000 | 0.000000 | 0.000000 |
6.660470 | -0.068876 | 0.095320 | -0.161942 | 0.000000 | 0.000000 | 0.000000 |
1.946960 | 0.239559 | -0.421343 | 1.042155 | 0.000000 | 0.000000 | 0.000000 |
0.984706 | 0.387323 | -0.506933 | -0.264865 | 0.000000 | 0.000000 | 0.000000 |
0.474655 | 0.348756 | 0.285466 | -1.116305 | 0.000000 | 0.000000 | 0.000000 |
0.216558 | 0.198492 | 0.582565 | 0.545762 | 0.000000 | 0.000000 | 0.000000 |
0.091472 | 0.049879 | 0.219462 | 0.499622 | 1.000000 | 0.000000 | 0.000000 |
3.469600 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
1.217100 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set of Peterson and Puzzarini, Ref 39, for PP of Ref 37.