MOLPRO Basis Query, element=Po, basis=cc-pwCVQZ-DK3, l=s
Basis Po s cc-pwCVQZ-DK3
Primitives | Contractions... |
827202910.000000 | 0.000219 | -0.000088 | 0.000042 | -0.000021 | -0.000010 | 0.000004 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
241441220.000000 | 0.000184 | -0.000073 | 0.000035 | -0.000018 | -0.000008 | 0.000003 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
76967058.000000 | 0.000621 | -0.000248 | 0.000120 | -0.000061 | -0.000028 | 0.000010 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
26375369.000000 | 0.000964 | -0.000384 | 0.000186 | -0.000094 | -0.000043 | 0.000016 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
9589129.400000 | 0.001961 | -0.000782 | 0.000378 | -0.000192 | -0.000088 | 0.000032 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3659371.400000 | 0.003347 | -0.001336 | 0.000645 | -0.000328 | -0.000151 | 0.000055 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1453467.300000 | 0.006042 | -0.002420 | 0.001170 | -0.000594 | -0.000273 | 0.000100 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
596977.150000 | 0.010347 | -0.004164 | 0.002014 | -0.001023 | -0.000470 | 0.000171 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
252345.430000 | 0.017948 | -0.007282 | 0.003527 | -0.001792 | -0.000824 | 0.000301 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
109418.790000 | 0.030566 | -0.012560 | 0.006097 | -0.003098 | -0.001424 | 0.000519 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
48568.469000 | 0.052129 | -0.021850 | 0.010643 | -0.005415 | -0.002490 | 0.000909 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
22045.323000 | 0.087526 | -0.037840 | 0.018527 | -0.009433 | -0.004336 | 0.001582 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
10228.922000 | 0.143091 | -0.064977 | 0.032100 | -0.016394 | -0.007547 | 0.002755 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4852.404500 | 0.216924 | -0.106530 | 0.053360 | -0.027310 | -0.012566 | 0.004586 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2354.306400 | 0.277958 | -0.153826 | 0.078911 | -0.040724 | -0.018810 | 0.006873 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1168.713100 | 0.250004 | -0.153544 | 0.080364 | -0.041474 | -0.019085 | 0.006959 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
593.661660 | 0.116055 | 0.004493 | -0.014585 | 0.008940 | 0.004170 | -0.001511 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
308.448640 | 0.016059 | 0.348508 | -0.287468 | 0.168114 | 0.080386 | -0.029605 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
163.733540 | 0.000946 | 0.507749 | -0.539359 | 0.333317 | 0.160316 | -0.058960 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
88.606441 | -0.000514 | 0.240770 | -0.215831 | 0.146035 | 0.075181 | -0.028257 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
48.717356 | 0.000389 | 0.027644 | 0.620716 | -0.651505 | -0.367674 | 0.140248 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
27.080644 | -0.000351 | 0.001069 | 0.640843 | -0.881916 | -0.511712 | 0.194858 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
15.118113 | 0.000257 | -0.000320 | 0.138073 | 0.198384 | 0.153772 | -0.058113 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
8.403081 | -0.000165 | -0.000021 | 0.012288 | 0.940451 | 0.979401 | -0.434400 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4.599872 | 0.000101 | -0.000040 | -0.002235 | 0.392908 | 0.546767 | -0.247671 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2.446809 | -0.000055 | 0.000024 | 0.001406 | 0.016382 | -0.795627 | 0.488364 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.233519 | 0.000026 | -0.000001 | -0.000866 | 0.005386 | -0.764036 | 0.656870 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.522326 | -0.000018 | 0.000003 | 0.000552 | -0.002686 | -0.097881 | -0.010105 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.314539 | 0.000013 | -0.000002 | -0.000403 | 0.001992 | 0.016928 | -0.591207 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.156952 | -0.000004 | 0.000001 | 0.000138 | -0.000699 | -0.003780 | -0.559887 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.073451 | 0.000001 | -0.000000 | -0.000029 | 0.000143 | 0.000531 | -0.142441 | 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)
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