Primitives | Contractions... | |||
---|---|---|---|---|
28.070720 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
18.747640 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
1.942620 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.624111 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Theory Comput. 8, 518 (2012).