Primitives | Contractions... | |||
---|---|---|---|---|
13.313620 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
2.207353 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.928669 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.203247 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: R.A. Shaw and J.G. Hill, J. Chem. Theory Comput. 13, 1691 (2017).