Primitives | Contractions... | |||
---|---|---|---|---|
10.338980 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
3.486805 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.837706 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.235400 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: R.A. Shaw and J.G. Hill, J. Chem. Theory Comput. 13, 1691 (2017).