Primitives | Contractions... | |||
---|---|---|---|---|
37.548800 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
4.193614 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
1.682226 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.624579 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: R.A. Shaw and J.G. Hill, J. Chem. Theory Comput. 13, 1691 (2017).