Primitives | Contractions... | |||
---|---|---|---|---|
66.017420 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
6.434211 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
2.400063 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.889551 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: R.A. Shaw and J.G. Hill, J. Chem. Theory Comput. 13, 1691 (2017).