Primitives | Contractions... | |||
---|---|---|---|---|
2.825270 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
1.720470 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.952568 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.527406 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pVQZ-PP/MP2Fit: J.G. Hill JCP 135, 044105 (2011)