Primitives | Contractions... | |||
---|---|---|---|---|
6.818929 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
1.164611 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.747203 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.177919 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: R.A. Shaw and J.G. Hill, J. Chem. Theory Comput. 13, 1691 (2017).