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Modified
| A | B | C |
|---|---|---|
| X1 | Y1 | X2 |
| 200.028 | 1.10584 | 200.19307 |
| 200.59663 | 1.09302 | 200.75782 |
| 201.14215 | 1.07782 | 201.23566 |
| 201.96837 | 1.05659 | 201.69531 |
| 202.79459 | 1.03757 | 202.06972 |
| 203.62081 | 1.02059 | 202.44621 |
| 204.44703 | 1.00488 | 202.82848 |
| 205.27325 | 0.98712 | 203.23527 |
| 206.09948 | 0.97046 | 203.62489 |
| Col1 | Col2 | Col3 |
|---|---|---|
| hf | mp2 | |
| -2.2 | -1.9312 | -0.0887 |
| -2 | -0.9104 | -0.2933 |
| -1.8 | 0.0000 | 0.0000 |
| -1.6 | 2.0032 | 0.4893 |
| -1.4 | 5.0867 | 1.5708 |
| -1.2 | 9.9698 | 3.6036 |
| -1 | 16.5063 | 6.6193 |
| -0.9 | 20.9214 | 8.6598 |
| -0.8 | 25.2084 | 10.2018 |
| basis set size | s-functions | p-functions |
|---|---|---|
| 2 | 40.9808280924 | |
| 3 | 39.0307856494 | 41.0815580336 |
| 4 | 39.6571460851 | 42.0336200168 |
| 5 | 40.8342379977 | 33.3333785647 |
| 6 | 39.7005288232 | 17.4212122522 |
| 7 | 31.2051322867 | 11.8905786343 |
| 8 | 27.1095309565 | 9.0486165503 |
| 9 | 24.7271008083 | 5.17720538811 |
| 10 | 20.458440157 | 4.55859800739 |
| 11 | 17.8951743343 | 5.20669613861 |