MOLPRO Basis Query, element=Mn, basis=cc-pV5Z-DK, l=d
Basis Mn d cc-pV5Z-DK
| Primitives | Contractions... |
|---|
| 449.785000 | 0.000169 | -0.000173 | -0.000273 | -0.000345 | 0.000443 | 0.000000 |
| 132.751000 | 0.001538 | -0.001571 | -0.002489 | -0.003123 | 0.004125 | 0.000000 |
| 50.952800 | 0.008367 | -0.008577 | -0.013724 | -0.017455 | 0.022736 | 0.000000 |
| 22.159400 | 0.030314 | -0.031252 | -0.050603 | -0.064495 | 0.089440 | 0.000000 |
| 10.261200 | 0.082802 | -0.087388 | -0.147327 | -0.202209 | 0.300459 | 0.000000 |
| 4.978030 | 0.172377 | -0.182842 | -0.297421 | -0.404463 | 0.453971 | 0.000000 |
| 2.457300 | 0.260866 | -0.250562 | -0.273854 | -0.024976 | -0.829863 | 0.000000 |
| 1.201010 | 0.301135 | -0.172550 | 0.190155 | 0.927209 | -0.528036 | 0.000000 |
| 0.572516 | 0.271371 | 0.118337 | 0.628642 | -0.072557 | 1.609221 | 0.000000 |
| 0.262596 | 0.178074 | 0.419952 | 0.105866 | -0.987752 | -0.953577 | 0.000000 |
| 0.114140 | 0.067774 | 0.409276 | -0.575165 | 0.439301 | -0.384243 | 0.000000 |
| 0.045642 | 0.007078 | 0.108855 | -0.238090 | 0.431800 | 0.768955 | 1.000000 |
Comment: N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 123, 064107 (2005)