MOLPRO Basis Query, element=Md, basis=cc-pwCVQZ-DK3, l=p
Basis Md p cc-pwCVQZ-DK3
| Primitives | Contractions... |
|---|
| 78348096.000000 | 0.000026 | -0.000033 | 0.000001 | -0.000005 | 0.000002 | -0.000000 | -0.000002 | 0.000003 | 0.000004 | 0.000004 | 0.000000 | 0.000000 | 0.000000 |
| 30489278.000000 | 0.000009 | -0.000012 | 0.000000 | -0.000002 | 0.000001 | -0.000000 | -0.000001 | 0.000001 | 0.000001 | 0.000002 | 0.000000 | 0.000000 | 0.000000 |
| 11912420.000000 | 0.000061 | -0.000079 | 0.000003 | -0.000012 | 0.000005 | -0.000001 | -0.000004 | 0.000006 | 0.000009 | 0.000010 | 0.000000 | 0.000000 | 0.000000 |
| 4828946.000000 | 0.000072 | -0.000093 | 0.000003 | -0.000014 | 0.000006 | -0.000001 | -0.000005 | 0.000007 | 0.000011 | 0.000012 | 0.000000 | 0.000000 | 0.000000 |
| 2018516.800000 | 0.000175 | -0.000226 | 0.000008 | -0.000033 | 0.000015 | -0.000003 | -0.000012 | 0.000018 | 0.000026 | 0.000029 | 0.000000 | 0.000000 | 0.000000 |
| 867443.060000 | 0.000286 | -0.000369 | 0.000014 | -0.000055 | 0.000024 | -0.000005 | -0.000020 | 0.000030 | 0.000042 | 0.000048 | 0.000000 | 0.000000 | 0.000000 |
| 382093.530000 | 0.000575 | -0.000743 | 0.000028 | -0.000110 | 0.000048 | -0.000010 | -0.000040 | 0.000060 | 0.000085 | 0.000095 | 0.000000 | 0.000000 | 0.000000 |
| 172182.660000 | 0.001053 | -0.001365 | 0.000053 | -0.000204 | 0.000089 | -0.000018 | -0.000074 | 0.000110 | 0.000157 | 0.000178 | 0.000000 | 0.000000 | 0.000000 |
| 79275.850000 | 0.002084 | -0.002710 | 0.000108 | -0.000405 | 0.000177 | -0.000036 | -0.000147 | 0.000219 | 0.000309 | 0.000345 | 0.000000 | 0.000000 | 0.000000 |
| 37292.074000 | 0.004086 | -0.005344 | 0.000219 | -0.000803 | 0.000351 | -0.000071 | -0.000290 | 0.000432 | 0.000621 | 0.000708 | 0.000000 | 0.000000 | 0.000000 |
| 17940.160000 | 0.008310 | -0.010942 | 0.000463 | -0.001650 | 0.000722 | -0.000145 | -0.000597 | 0.000891 | 0.001257 | 0.001391 | 0.000000 | 0.000000 | 0.000000 |
| 8841.754500 | 0.016942 | -0.022540 | 0.001008 | -0.003430 | 0.001502 | -0.000302 | -0.001239 | 0.001847 | 0.002666 | 0.003059 | 0.000000 | 0.000000 | 0.000000 |
| 4472.416600 | 0.034486 | -0.046544 | 0.002217 | -0.007152 | 0.003130 | -0.000630 | -0.002589 | 0.003864 | 0.005424 | 0.005958 | 0.000000 | 0.000000 | 0.000000 |
| 2324.437400 | 0.067215 | -0.092712 | 0.004867 | -0.014498 | 0.006347 | -0.001278 | -0.005235 | 0.007804 | 0.011344 | 0.013151 | 0.000000 | 0.000000 | 0.000000 |
| 1240.549100 | 0.119455 | -0.169509 | 0.009884 | -0.027017 | 0.011821 | -0.002380 | -0.009792 | 0.014623 | 0.020350 | 0.022023 | 0.000000 | 0.000000 | 0.000000 |
| 678.558280 | 0.178961 | -0.262451 | 0.017272 | -0.042959 | 0.018808 | -0.003788 | -0.015490 | 0.023081 | 0.034190 | 0.040739 | 0.000000 | 0.000000 | 0.000000 |
| 379.630960 | 0.205860 | -0.291657 | 0.016323 | -0.045988 | 0.020100 | -0.004044 | -0.016741 | 0.025060 | 0.032911 | 0.032018 | 0.000000 | 0.000000 | 0.000000 |
| 216.053450 | 0.179966 | -0.122887 | -0.027079 | -0.000358 | 0.000169 | -0.000030 | 0.000239 | -0.000717 | 0.004608 | 0.015239 | 0.000000 | 0.000000 | 0.000000 |
| 124.644460 | 0.166618 | 0.249574 | -0.151264 | 0.119714 | -0.052849 | 0.010692 | 0.043575 | -0.065445 | -0.108570 | -0.147653 | 0.000000 | 0.000000 | 0.000000 |
| 73.447998 | 0.184700 | 0.519927 | -0.281618 | 0.233148 | -0.102853 | 0.020782 | 0.087465 | -0.134142 | -0.176330 | -0.174230 | 0.000000 | 0.000000 | 0.000000 |
| 43.375518 | 0.126152 | 0.350494 | -0.116766 | 0.097355 | -0.041760 | 0.008415 | 0.031140 | -0.041420 | -0.092930 | -0.154646 | 0.000000 | 0.000000 | 0.000000 |
| 25.515217 | 0.032613 | -0.012238 | 0.341936 | -0.283575 | 0.135179 | -0.027788 | -0.113778 | 0.180686 | 0.396659 | 0.673752 | 0.000000 | 0.000000 | 0.000000 |
| 15.291186 | -0.001149 | -0.162948 | 0.568054 | -0.570558 | 0.281315 | -0.057904 | -0.252105 | 0.390875 | 0.398930 | 0.137185 | 0.000000 | 0.000000 | 0.000000 |
| 9.121540 | -0.001774 | -0.084186 | 0.286775 | -0.149395 | 0.048375 | -0.009361 | -0.015044 | -0.003146 | 0.269082 | 0.895012 | 0.000000 | 0.000000 | 0.000000 |
| 5.340157 | -0.000185 | -0.010634 | 0.044058 | 0.524083 | -0.353268 | 0.076527 | 0.315394 | -0.577523 | -1.961620 | -4.963360 | 0.000000 | 0.000000 | 0.000000 |
| 3.072204 | 0.000202 | 0.003272 | -0.000838 | 0.561614 | -0.407016 | 0.089456 | 0.491031 | -0.868380 | -0.024415 | 5.858760 | 0.000000 | 0.000000 | 0.000000 |
| 1.718785 | 0.000067 | 0.001137 | -0.000792 | 0.191695 | -0.012160 | -0.001561 | -0.252737 | 1.212960 | 3.510670 | -0.822504 | 0.000000 | 0.000000 | 0.000000 |
| 0.948294 | 0.000012 | 0.000229 | -0.000162 | 0.030714 | 0.398205 | -0.104071 | -0.744906 | 0.971416 | -2.503490 | -4.648130 | 0.000000 | 0.000000 | 0.000000 |
| 0.513308 | 0.000002 | 0.000023 | 0.000016 | 0.015623 | 0.484201 | -0.148104 | -0.151083 | -0.962741 | -1.180270 | 5.173100 | 0.000000 | 0.000000 | 0.000000 |
| 0.273024 | 0.000001 | 0.000033 | 0.000001 | 0.006929 | 0.261730 | -0.122102 | 0.316629 | -0.925961 | 1.842760 | -1.596980 | 0.000000 | 0.000000 | 0.000000 |
| 0.135702 | 0.000000 | -0.000003 | 0.000007 | 0.001537 | 0.051965 | 0.076860 | 0.541657 | 0.517356 | 0.160880 | -1.255580 | 0.000000 | 0.000000 | 0.000000 |
| 0.064930 | 0.000000 | 0.000003 | -0.000001 | -0.000006 | 0.003234 | 0.416169 | 0.277337 | 0.572114 | -0.757031 | 0.992541 | 0.000000 | 0.000000 | 0.000000 |
| 0.030908 | -0.000000 | -0.000001 | 0.000001 | 0.000058 | 0.000982 | 0.497143 | 0.027256 | 0.045661 | -0.055810 | 0.126854 | 0.000000 | 0.000000 | 0.000000 |
| 0.014594 | 0.000000 | 0.000000 | -0.000000 | -0.000013 | -0.000134 | 0.159556 | 0.001347 | 0.005854 | -0.011125 | 0.009422 | 1.000000 | 0.000000 | 0.000000 |
| 10.166827 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 6.302320 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)
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