Primitives | Contractions... | |||
---|---|---|---|---|
5.113380 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
3.408193 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
1.649750 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.704098 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Theory Comput. 8, 518 (2012).