Primitives | Contractions... | |||
---|---|---|---|---|
2.069040 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
1.119180 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.657505 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.386278 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pVQZ-PP/MP2Fit: J.G. Hill JCP 135, 044105 (2011)