MOLPRO Basis Query, element=Pm, basis=cc-pwCVTZ-DK3, l=s
Basis Pm s cc-pwCVTZ-DK3
Primitives | Contractions... |
71784670.000000 | 0.000254 | -0.000132 | 0.000074 | -0.000017 | 0.000009 | -0.000005 | -0.000008 | 0.000011 | 0.000014 | 0.000000 | 0.000000 | 0.000000 |
18892770.000000 | 0.000267 | -0.000138 | 0.000077 | -0.000018 | 0.000010 | -0.000005 | -0.000009 | 0.000012 | 0.000015 | 0.000000 | 0.000000 | 0.000000 |
6329847.000000 | 0.000750 | -0.000389 | 0.000218 | -0.000051 | 0.000027 | -0.000015 | -0.000024 | 0.000033 | 0.000042 | 0.000000 | 0.000000 | 0.000000 |
2331188.000000 | 0.001167 | -0.000605 | 0.000340 | -0.000079 | 0.000042 | -0.000023 | -0.000037 | 0.000051 | 0.000066 | 0.000000 | 0.000000 | 0.000000 |
923397.300000 | 0.002353 | -0.001223 | 0.000687 | -0.000160 | 0.000085 | -0.000047 | -0.000075 | 0.000103 | 0.000132 | 0.000000 | 0.000000 | 0.000000 |
382823.800000 | 0.004047 | -0.002108 | 0.001187 | -0.000277 | 0.000147 | -0.000081 | -0.000131 | 0.000179 | 0.000234 | 0.000000 | 0.000000 | 0.000000 |
165149.700000 | 0.007457 | -0.003899 | 0.002201 | -0.000513 | 0.000273 | -0.000150 | -0.000242 | 0.000331 | 0.000417 | 0.000000 | 0.000000 | 0.000000 |
73643.840000 | 0.013138 | -0.006911 | 0.003916 | -0.000915 | 0.000486 | -0.000267 | -0.000433 | 0.000593 | 0.000789 | 0.000000 | 0.000000 | 0.000000 |
33857.140000 | 0.023699 | -0.012583 | 0.007175 | -0.001679 | 0.000891 | -0.000490 | -0.000789 | 0.001080 | 0.001326 | 0.000000 | 0.000000 | 0.000000 |
16004.300000 | 0.042158 | -0.022708 | 0.013070 | -0.003069 | 0.001631 | -0.000897 | -0.001459 | 0.001993 | 0.002742 | 0.000000 | 0.000000 | 0.000000 |
7762.535000 | 0.074802 | -0.041258 | 0.024115 | -0.005688 | 0.003018 | -0.001657 | -0.002658 | 0.003645 | 0.004265 | 0.000000 | 0.000000 | 0.000000 |
3854.677000 | 0.127198 | -0.072950 | 0.043686 | -0.010401 | 0.005522 | -0.003038 | -0.004972 | 0.006784 | 0.009825 | 0.000000 | 0.000000 | 0.000000 |
1955.677000 | 0.197027 | -0.121129 | 0.075605 | -0.018238 | 0.009657 | -0.005298 | -0.008442 | 0.011606 | 0.012411 | 0.000000 | 0.000000 | 0.000000 |
1011.898000 | 0.248654 | -0.172109 | 0.114578 | -0.028353 | 0.015020 | -0.008278 | -0.013714 | 0.018669 | 0.030095 | 0.000000 | 0.000000 | 0.000000 |
532.828300 | 0.215232 | -0.176219 | 0.127664 | -0.032548 | 0.017135 | -0.009368 | -0.014503 | 0.020157 | 0.012745 | 0.000000 | 0.000000 | 0.000000 |
284.586900 | 0.105821 | -0.051690 | 0.027088 | -0.006262 | 0.003435 | -0.002001 | -0.004646 | 0.005704 | 0.035659 | 0.000000 | 0.000000 | 0.000000 |
151.191900 | 0.060037 | 0.211667 | -0.282554 | 0.092103 | -0.048254 | 0.026821 | 0.046820 | -0.063389 | -0.144319 | 0.000000 | 0.000000 | 0.000000 |
82.522030 | 0.072211 | 0.351592 | -0.620665 | 0.231649 | -0.119884 | 0.065607 | 0.101717 | -0.144589 | -0.065431 | 0.000000 | 0.000000 | 0.000000 |
45.217850 | 0.042711 | 0.204289 | -0.436165 | 0.186030 | -0.098490 | 0.055554 | 0.103380 | -0.138025 | -0.425835 | 0.000000 | 0.000000 | 0.000000 |
23.885580 | 0.025301 | 0.157022 | 0.382643 | -0.286179 | 0.154236 | -0.088404 | -0.172823 | 0.233769 | 0.831123 | 0.000000 | 0.000000 | 0.000000 |
13.600290 | 0.028784 | 0.194418 | 0.746622 | -0.798021 | 0.444012 | -0.248053 | -0.410469 | 0.672512 | 0.134012 | 0.000000 | 0.000000 | 0.000000 |
7.558101 | 0.010817 | 0.072741 | 0.270126 | -0.204285 | 0.107530 | -0.065938 | -0.151288 | 0.084782 | 1.377210 | 0.000000 | 0.000000 | 0.000000 |
3.976805 | 0.000237 | 0.000734 | -0.025241 | 0.774829 | -0.561576 | 0.347359 | 0.903990 | -1.647350 | -5.976200 | 0.000000 | 0.000000 | 0.000000 |
2.106473 | -0.000265 | -0.002486 | -0.032450 | 0.565270 | -0.646351 | 0.409944 | 0.662185 | -0.537799 | 6.019390 | 0.000000 | 0.000000 | 0.000000 |
0.960839 | -0.000062 | -0.000496 | -0.004326 | 0.085437 | 0.199536 | -0.142612 | -1.416510 | 4.493730 | 0.255601 | 0.000000 | 0.000000 | 0.000000 |
0.503142 | -0.000002 | -0.000061 | -0.001592 | 0.061913 | 0.670252 | -0.606803 | -1.045250 | -3.525880 | -5.753260 | 0.000000 | 0.000000 | 0.000000 |
0.243820 | -0.000011 | -0.000091 | -0.000853 | 0.028104 | 0.242625 | -0.373045 | 1.594640 | -0.377926 | 5.210650 | 0.000000 | 0.000000 | 0.000000 |
0.062797 | 0.000001 | -0.000000 | -0.000109 | 0.006258 | 0.164261 | 0.495722 | 1.051990 | 2.722050 | -3.044780 | 0.000000 | 0.000000 | 0.000000 |
0.032516 | -0.000002 | -0.000017 | -0.000122 | 0.005760 | 0.151059 | 0.501708 | -1.194810 | -1.808480 | 1.270000 | 0.000000 | 0.000000 | 0.000000 |
0.016177 | 0.000000 | -0.000001 | -0.000032 | 0.001868 | 0.051101 | 0.162441 | -0.178206 | -0.206969 | 0.376057 | 1.000000 | 0.000000 | 0.000000 |
9.635924 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
6.063760 | 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: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
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