Primitives | Contractions... | |||
---|---|---|---|---|
29.676850 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
17.109170 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
3.417191 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.948234 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Theory Comput. 8, 518 (2012).