Primitives | Contractions... | |||
---|---|---|---|---|
5.861809 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
3.261856 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
1.402481 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.532453 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Theory Comput. 8, 518 (2012).