MOLPRO Basis Query, element=Zr, basis=cc-pwCVTZ-PP, l=s
Basis Zr s cc-pwCVTZ-PP
Primitives | Contractions... |
136.826000 | 0.000409 | -0.000142 | -0.000031 | 0.000094 | 0.000000 | 0.000000 | 0.000000 |
14.512800 | -0.038517 | 0.013145 | 0.001919 | -0.010988 | 0.000000 | 0.000000 | 0.000000 |
9.069810 | 0.215815 | -0.075341 | -0.050977 | -0.030538 | 0.000000 | 0.000000 | 0.000000 |
5.666400 | -0.173340 | 0.069978 | -0.015384 | -0.096135 | 0.000000 | 0.000000 | 0.000000 |
3.113190 | -0.470067 | 0.150436 | 0.435166 | 0.802308 | 0.000000 | 0.000000 | 0.000000 |
0.823482 | 0.763461 | -0.325382 | -1.191112 | -3.234863 | 0.000000 | 0.000000 | 0.000000 |
0.381193 | 0.503740 | -0.356712 | 0.129257 | 3.497827 | 0.000000 | 0.000000 | 0.000000 |
0.097792 | 0.037859 | 0.307014 | 2.649443 | -0.746884 | 0.000000 | 0.000000 | 0.000000 |
0.050839 | -0.015390 | 0.623918 | -1.870032 | -1.781595 | 0.000000 | 0.000000 | 0.000000 |
0.023693 | 0.004804 | 0.268005 | -0.377907 | 1.744201 | 1.000000 | 0.000000 | 0.000000 |
1.258400 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.786800 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: Peterson et al., Ref 43.