MOLPRO Basis Query, element=Rn, basis=V5Z-PP, l=s
Basis Rn s V5Z-PP
Primitives | Contractions... |
30127.100000 | 0.000016 | -0.000009 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4530.140000 | 0.000122 | -0.000072 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1029.790000 | 0.000559 | -0.000322 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
286.391000 | 0.001497 | -0.000908 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
65.269300 | 0.004555 | -0.002283 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
25.228700 | -0.109085 | 0.053902 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
15.759000 | 0.517067 | -0.277133 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
9.843680 | -0.476041 | 0.309765 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
6.010840 | -0.724170 | 0.346849 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3.182800 | 0.301850 | -0.208118 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.923990 | 0.830126 | -0.653628 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.094160 | 0.402078 | -0.431970 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.538540 | 0.036265 | 0.349722 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.286498 | -0.002264 | 0.659172 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.147443 | 0.000913 | 0.366531 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.072038 | -0.000121 | 0.049942 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: cc-pV5Z (16s13p12d3f2g1h)/[7s7p5d3f2g1h] basis set for ECP60MDF by K.A. Peterson et al, Ref 36.