MOLPRO Basis Query, element=Fe, basis=cc-pVTZ, l=p
Basis Fe p cc-pVTZ
| Primitives | Contractions... |
|---|
| 17745.690000 | 0.000041 | -0.000015 | 0.000003 | 0.000005 | 0.000011 | 0.000000 |
| 4200.721000 | 0.000369 | -0.000130 | 0.000029 | 0.000042 | 0.000087 | 0.000000 |
| 1364.429000 | 0.002129 | -0.000751 | 0.000165 | 0.000241 | 0.000541 | 0.000000 |
| 522.080600 | 0.009369 | -0.003329 | 0.000734 | 0.001085 | 0.002226 | 0.000000 |
| 221.459500 | 0.033097 | -0.011912 | 0.002626 | 0.003831 | 0.008593 | 0.000000 |
| 100.909600 | 0.094431 | -0.034933 | 0.007725 | 0.011423 | 0.023339 | 0.000000 |
| 48.401150 | 0.208077 | -0.079989 | 0.017733 | 0.025792 | 0.058844 | 0.000000 |
| 23.985360 | 0.332333 | -0.134636 | 0.030055 | 0.044818 | 0.088289 | 0.000000 |
| 12.182500 | 0.332987 | -0.138598 | 0.031094 | 0.044598 | 0.123192 | 0.000000 |
| 6.242298 | 0.156843 | 0.030278 | -0.010048 | -0.011177 | -0.063186 | 0.000000 |
| 3.110944 | 0.021549 | 0.333216 | -0.088306 | -0.138134 | -0.354902 | 0.000000 |
| 1.509958 | -0.002095 | 0.456153 | -0.129824 | -0.188285 | -0.619708 | 0.000000 |
| 0.710845 | -0.001739 | 0.285051 | -0.076937 | -0.107399 | 0.812986 | 0.000000 |
| 0.273190 | -0.000300 | 0.046144 | 0.212661 | 0.444863 | 0.819118 | 0.000000 |
| 0.104233 | 0.000029 | -0.003249 | 0.573061 | 0.640239 | -0.901705 | 0.000000 |
| 0.038291 | -0.000011 | 0.001357 | 0.369651 | 0.064457 | -0.135913 | 1.000000 |
Comment: N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 123, 064107 (2005)