Primitives | Contractions... | |||
---|---|---|---|---|
12.825190 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
5.121742 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
2.228789 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.933643 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Theory Comput. 8, 518 (2012).