MOLPRO Basis Query, element=Ir, basis=VTZ-DK, l=p
Basis Ir p VTZ-DK
Primitives | Contractions... |
375681800.000000 | 0.000003 | -0.000001 | 0.000001 | -0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
63657130.000000 | 0.000008 | -0.000004 | 0.000002 | -0.000001 | 0.000000 | 0.000000 | 0.000001 | 0.000000 |
13078820.000000 | 0.000024 | -0.000012 | 0.000006 | -0.000002 | 0.000001 | 0.000001 | 0.000002 | 0.000000 |
3173056.000000 | 0.000062 | -0.000031 | 0.000016 | -0.000006 | 0.000002 | 0.000003 | 0.000005 | 0.000000 |
887984.300000 | 0.000153 | -0.000078 | 0.000040 | -0.000014 | 0.000004 | 0.000008 | 0.000011 | 0.000000 |
280811.500000 | 0.000367 | -0.000187 | 0.000096 | -0.000035 | 0.000010 | 0.000018 | 0.000027 | 0.000000 |
98559.870000 | 0.000873 | -0.000446 | 0.000229 | -0.000082 | 0.000023 | 0.000044 | 0.000065 | 0.000000 |
37799.070000 | 0.002086 | -0.001070 | 0.000550 | -0.000198 | 0.000055 | 0.000104 | 0.000155 | 0.000000 |
15627.900000 | 0.005049 | -0.002604 | 0.001339 | -0.000483 | 0.000134 | 0.000255 | 0.000378 | 0.000000 |
6885.277000 | 0.012355 | -0.006429 | 0.003313 | -0.001194 | 0.000332 | 0.000628 | 0.000936 | 0.000000 |
3200.527000 | 0.030035 | -0.015825 | 0.008182 | -0.002952 | 0.000821 | 0.001565 | 0.002313 | 0.000000 |
1556.293000 | 0.070155 | -0.037815 | 0.019650 | -0.007096 | 0.001970 | 0.003728 | 0.005566 | 0.000000 |
785.834400 | 0.147603 | -0.082178 | 0.043058 | -0.015588 | 0.004336 | 0.008279 | 0.012220 | 0.000000 |
409.397400 | 0.257237 | -0.150032 | 0.079494 | -0.028850 | 0.008009 | 0.015115 | 0.022665 | 0.000000 |
218.796600 | 0.327158 | -0.195117 | 0.104106 | -0.037875 | 0.010556 | 0.020308 | 0.029716 | 0.000000 |
119.322600 | 0.249356 | -0.090957 | 0.037029 | -0.012271 | 0.003329 | 0.005740 | 0.009514 | 0.000000 |
66.068100 | 0.088989 | 0.224282 | -0.179850 | 0.071761 | -0.019969 | -0.036863 | -0.057984 | 0.000000 |
36.952110 | 0.009621 | 0.492003 | -0.419576 | 0.171931 | -0.048473 | -0.094850 | -0.138014 | 0.000000 |
20.765610 | 0.000337 | 0.333535 | -0.206478 | 0.070464 | -0.019002 | -0.031584 | -0.056830 | 0.000000 |
11.656600 | -0.000150 | 0.082659 | 0.354450 | -0.201741 | 0.057472 | 0.103544 | 0.189492 | 0.000000 |
6.493306 | 0.000144 | 0.014568 | 0.587190 | -0.371544 | 0.110123 | 0.225270 | 0.305317 | 0.000000 |
3.562449 | 0.000013 | 0.004273 | 0.280407 | -0.139832 | 0.037671 | 0.053291 | 0.194181 | 0.000000 |
1.908167 | 0.000025 | 0.000600 | 0.028620 | 0.388677 | -0.132302 | -0.251909 | -0.821005 | 0.000000 |
0.976001 | -0.000015 | -0.000033 | -0.005150 | 0.552510 | -0.237942 | -0.574775 | -0.789881 | 0.000000 |
0.476936 | 0.000001 | 0.000022 | -0.004061 | 0.269978 | -0.068223 | 0.208775 | 1.809127 | 0.000000 |
0.191703 | -0.000002 | -0.000009 | -0.000305 | 0.034156 | 0.341534 | 0.791438 | -0.252754 | 0.000000 |
0.079797 | 0.000001 | 0.000003 | -0.000061 | -0.001230 | 0.566073 | 0.222632 | -0.795444 | 0.000000 |
0.032546 | -0.000000 | -0.000001 | 0.000013 | 0.000727 | 0.255492 | 0.006270 | 0.019406 | 1.000000 |
Comment: basis set from gbasis database