MOLPRO Basis Query, element=Pa, basis=cc-pwCVTZ-X2C, l=p
Basis Pa p cc-pwCVTZ-X2C
| Primitives | Contractions... |
|---|
| 52575799.000000 | 0.000013 | -0.000015 | 0.000002 | -0.000002 | 0.000001 | -0.000000 | -0.000001 | -0.000001 | -0.000001 | 0.000000 | 0.000000 | 0.000000 |
| 15301659.000000 | 0.000017 | -0.000020 | 0.000002 | -0.000003 | 0.000001 | -0.000000 | -0.000001 | -0.000001 | -0.000002 | 0.000000 | 0.000000 | 0.000000 |
| 4822461.600000 | 0.000052 | -0.000063 | 0.000007 | -0.000009 | 0.000004 | -0.000001 | -0.000003 | -0.000004 | -0.000006 | 0.000000 | 0.000000 | 0.000000 |
| 1632045.600000 | 0.000107 | -0.000128 | 0.000015 | -0.000018 | 0.000008 | -0.000002 | -0.000005 | -0.000009 | -0.000012 | 0.000000 | 0.000000 | 0.000000 |
| 584338.640000 | 0.000256 | -0.000307 | 0.000036 | -0.000043 | 0.000019 | -0.000005 | -0.000013 | -0.000021 | -0.000030 | 0.000000 | 0.000000 | 0.000000 |
| 219508.320000 | 0.000572 | -0.000688 | 0.000081 | -0.000097 | 0.000043 | -0.000010 | -0.000028 | -0.000047 | -0.000066 | 0.000000 | 0.000000 | 0.000000 |
| 86085.039000 | 0.001336 | -0.001611 | 0.000191 | -0.000228 | 0.000102 | -0.000024 | -0.000066 | -0.000111 | -0.000157 | 0.000000 | 0.000000 | 0.000000 |
| 35172.956000 | 0.003129 | -0.003789 | 0.000452 | -0.000537 | 0.000240 | -0.000058 | -0.000156 | -0.000263 | -0.000360 | 0.000000 | 0.000000 | 0.000000 |
| 14975.745000 | 0.007503 | -0.009145 | 0.001103 | -0.001302 | 0.000583 | -0.000140 | -0.000379 | -0.000636 | -0.000908 | 0.000000 | 0.000000 | 0.000000 |
| 6652.821900 | 0.017986 | -0.022135 | 0.002719 | -0.003177 | 0.001422 | -0.000342 | -0.000925 | -0.001554 | -0.002110 | 0.000000 | 0.000000 | 0.000000 |
| 3084.270200 | 0.042103 | -0.052666 | 0.006655 | -0.007652 | 0.003426 | -0.000823 | -0.002224 | -0.003739 | -0.005394 | 0.000000 | 0.000000 | 0.000000 |
| 1489.211300 | 0.090969 | -0.116756 | 0.015415 | -0.017311 | 0.007745 | -0.001861 | -0.005040 | -0.008475 | -0.011352 | 0.000000 | 0.000000 | 0.000000 |
| 745.288670 | 0.167976 | -0.223673 | 0.031304 | -0.034068 | 0.015249 | -0.003664 | -0.009895 | -0.016642 | -0.024563 | 0.000000 | 0.000000 | 0.000000 |
| 384.521300 | 0.234709 | -0.322150 | 0.047289 | -0.050256 | 0.022470 | -0.005398 | -0.014653 | -0.024644 | -0.031084 | 0.000000 | 0.000000 | 0.000000 |
| 203.927220 | 0.220200 | -0.236330 | 0.017930 | -0.027762 | 0.012451 | -0.002991 | -0.007970 | -0.013367 | -0.026677 | 0.000000 | 0.000000 | 0.000000 |
| 110.523340 | 0.174708 | 0.145050 | -0.123036 | 0.078094 | -0.035134 | 0.008482 | 0.022757 | 0.038637 | 0.074398 | 0.000000 | 0.000000 | 0.000000 |
| 61.345569 | 0.190642 | 0.527334 | -0.327485 | 0.225253 | -0.101385 | 0.024454 | 0.067049 | 0.114090 | 0.122621 | 0.000000 | 0.000000 | 0.000000 |
| 34.404375 | 0.137246 | 0.400957 | -0.190153 | 0.124053 | -0.055104 | 0.013272 | 0.034635 | 0.057493 | 0.158055 | 0.000000 | 0.000000 | 0.000000 |
| 19.094147 | 0.033402 | 0.019469 | 0.365341 | -0.273486 | 0.131617 | -0.032305 | -0.086605 | -0.152735 | -0.396610 | 0.000000 | 0.000000 | 0.000000 |
| 10.684628 | -0.000867 | -0.122609 | 0.614487 | -0.553839 | 0.274237 | -0.067432 | -0.190567 | -0.335275 | -0.217370 | 0.000000 | 0.000000 | 0.000000 |
| 5.931463 | -0.000935 | -0.050931 | 0.253665 | -0.065277 | 0.008683 | -0.001366 | 0.011210 | 0.054116 | -0.310283 | 1.000000 | 0.000000 | 0.000000 |
| 3.230992 | -0.000009 | -0.002720 | 0.025247 | 0.618524 | -0.421618 | 0.110673 | 0.295370 | 0.556566 | 1.975310 | 0.000000 | 1.000000 | 0.000000 |
| 1.730655 | 0.000164 | 0.002231 | 0.001457 | 0.501044 | -0.381893 | 0.103187 | 0.357708 | 0.705542 | -0.901781 | 0.000000 | 0.000000 | 0.000000 |
| 0.869483 | 0.000022 | 0.000423 | -0.000189 | 0.107343 | 0.226214 | -0.077840 | -0.483437 | -1.835570 | -2.796670 | 0.000000 | 0.000000 | 0.000000 |
| 0.440589 | 0.000009 | 0.000084 | 0.000178 | 0.023201 | 0.602150 | -0.217735 | -0.603385 | -0.012121 | 4.376690 | 0.000000 | 0.000000 | 0.000000 |
| 0.215859 | -0.000000 | 0.000018 | -0.000001 | 0.014691 | 0.367232 | -0.188345 | 0.215887 | 1.665730 | -2.312120 | 0.000000 | 0.000000 | 0.000000 |
| 0.091015 | 0.000001 | 0.000006 | 0.000034 | 0.001511 | 0.055939 | 0.201020 | 0.715465 | -0.585220 | -0.328877 | 0.000000 | 0.000000 | 0.000000 |
| 0.040174 | -0.000000 | -0.000002 | -0.000010 | 0.000132 | -0.001129 | 0.637069 | 0.271767 | -0.541179 | 0.867979 | 0.000000 | 0.000000 | 0.000000 |
| 0.017215 | 0.000000 | 0.000001 | 0.000003 | -0.000015 | 0.001121 | 0.326669 | 0.004114 | 0.007323 | -0.037454 | 0.000000 | 0.000000 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)