Primitives | Contractions... | |||
---|---|---|---|---|
11.910440 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
5.413831 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
1.411074 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.440053 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: R.A. Shaw and J.G. Hill, J. Chem. Theory Comput. 13, 1691 (2017).