Primitives | Contractions... | |||
---|---|---|---|---|
6.317356 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.423865 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.093945 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.031078 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: R.A. Shaw and J.G. Hill, J. Chem. Theory Comput. 13, 1691 (2017).