MOLPRO Basis Query, element=Rn, basis=cc-pwCVQZ-DK3, l=s
Basis Rn s cc-pwCVQZ-DK3
| Primitives | Contractions... |
|---|
| 1040521000.000000 | 0.000214 | -0.000087 | 0.000042 | -0.000021 | -0.000010 | 0.000004 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 301330100.000000 | 0.000185 | -0.000074 | 0.000036 | -0.000018 | -0.000009 | 0.000003 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 95221480.000000 | 0.000613 | -0.000247 | 0.000120 | -0.000061 | -0.000029 | 0.000011 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 32341400.000000 | 0.000959 | -0.000386 | 0.000187 | -0.000096 | -0.000045 | 0.000017 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 11658420.000000 | 0.001942 | -0.000782 | 0.000379 | -0.000194 | -0.000091 | 0.000035 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 4414699.000000 | 0.003318 | -0.001338 | 0.000648 | -0.000331 | -0.000155 | 0.000060 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1741664.000000 | 0.005967 | -0.002413 | 0.001170 | -0.000597 | -0.000281 | 0.000108 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 711298.600000 | 0.010181 | -0.004136 | 0.002006 | -0.001025 | -0.000481 | 0.000186 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 299287.500000 | 0.017554 | -0.007186 | 0.003491 | -0.001784 | -0.000838 | 0.000324 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 129301.300000 | 0.029682 | -0.012297 | 0.005985 | -0.003059 | -0.001437 | 0.000555 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 57230.700000 | 0.050194 | -0.021189 | 0.010348 | -0.005296 | -0.002489 | 0.000961 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 25918.430000 | 0.083573 | -0.036317 | 0.017818 | -0.009125 | -0.004287 | 0.001655 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 12003.070000 | 0.135846 | -0.061804 | 0.030587 | -0.015714 | -0.007394 | 0.002857 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 5683.839000 | 0.206551 | -0.100981 | 0.050598 | -0.026033 | -0.012243 | 0.004727 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 2752.522000 | 0.270750 | -0.147808 | 0.075754 | -0.039303 | -0.018554 | 0.007176 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1363.476000 | 0.258773 | -0.157246 | 0.082155 | -0.042597 | -0.020036 | 0.007729 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 690.869200 | 0.135745 | -0.026533 | 0.005180 | -0.001850 | -0.000890 | 0.000368 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 357.929600 | 0.023773 | 0.301202 | -0.244709 | 0.143466 | 0.070135 | -0.027366 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 189.406000 | 0.001198 | 0.513031 | -0.525498 | 0.323431 | 0.158720 | -0.061741 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 102.175300 | -0.000444 | 0.284538 | -0.302510 | 0.207041 | 0.107833 | -0.042852 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 56.019480 | 0.000369 | 0.040369 | 0.534902 | -0.550457 | -0.316414 | 0.128171 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 31.080080 | -0.000355 | 0.001675 | 0.698753 | -0.945222 | -0.562775 | 0.227230 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 17.346430 | 0.000267 | -0.000507 | 0.179560 | 0.048308 | 0.052653 | -0.018423 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 9.664651 | -0.000177 | 0.000144 | 0.016964 | 0.941375 | 0.966011 | -0.454787 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 5.323568 | 0.000111 | -0.000167 | -0.002779 | 0.471738 | 0.699887 | -0.343696 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 2.864730 | -0.000060 | 0.000094 | 0.001801 | 0.026954 | -0.750565 | 0.491760 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.453699 | 0.000028 | -0.000033 | -0.001055 | 0.006277 | -0.846268 | 0.781559 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.606758 | -0.000017 | 0.000024 | 0.000632 | -0.002985 | -0.110904 | -0.061236 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.355988 | 0.000013 | -0.000017 | -0.000458 | 0.002190 | 0.022069 | -0.676169 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
| 0.178438 | -0.000004 | 0.000006 | 0.000169 | -0.000839 | -0.005653 | -0.507043 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 0.084911 | 0.000001 | -0.000001 | -0.000037 | 0.000178 | 0.000914 | -0.099991 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: D.H. Bross and K.A. Peterson, Theor. Chem. Acc. 133, 1434(2013)