MOLPRO Basis Query, element=Lu, basis=cc-pVQZ-X2C, l=s
Basis Lu s cc-pVQZ-X2C
Primitives | Contractions... |
65824060.000000 | 0.000696 | -0.000263 | 0.000124 | -0.000061 | 0.000024 | 0.000006 | -0.000029 | 0.000034 | 0.000042 | -0.000048 | 0.000000 |
17527400.000000 | 0.000531 | -0.000201 | 0.000095 | -0.000046 | 0.000018 | 0.000005 | -0.000022 | 0.000026 | 0.000032 | -0.000037 | 0.000000 |
6016747.000000 | 0.001652 | -0.000625 | 0.000295 | -0.000144 | 0.000056 | 0.000015 | -0.000068 | 0.000080 | 0.000100 | -0.000114 | 0.000000 |
2304105.000000 | 0.001917 | -0.000728 | 0.000344 | -0.000168 | 0.000065 | 0.000017 | -0.000079 | 0.000094 | 0.000116 | -0.000133 | 0.000000 |
968573.000000 | 0.004019 | -0.001528 | 0.000723 | -0.000352 | 0.000137 | 0.000036 | -0.000166 | 0.000196 | 0.000245 | -0.000278 | 0.000000 |
432074.600000 | 0.005471 | -0.002091 | 0.000990 | -0.000482 | 0.000187 | 0.000049 | -0.000228 | 0.000269 | 0.000335 | -0.000385 | 0.000000 |
202816.700000 | 0.009941 | -0.003818 | 0.001809 | -0.000881 | 0.000342 | 0.000089 | -0.000416 | 0.000492 | 0.000613 | -0.000692 | 0.000000 |
98729.910000 | 0.014844 | -0.005761 | 0.002734 | -0.001332 | 0.000518 | 0.000135 | -0.000629 | 0.000743 | 0.000926 | -0.001077 | 0.000000 |
49508.030000 | 0.025649 | -0.010064 | 0.004784 | -0.002332 | 0.000906 | 0.000236 | -0.001102 | 0.001306 | 0.001625 | -0.001803 | 0.000000 |
25410.680000 | 0.040442 | -0.016176 | 0.007714 | -0.003763 | 0.001463 | 0.000380 | -0.001777 | 0.002096 | 0.002614 | -0.003108 | 0.000000 |
13323.480000 | 0.067353 | -0.027612 | 0.013222 | -0.006457 | 0.002510 | 0.000653 | -0.003055 | 0.003627 | 0.004511 | -0.004859 | 0.000000 |
7123.844000 | 0.104763 | -0.044743 | 0.021573 | -0.010551 | 0.004103 | 0.001067 | -0.004985 | 0.005863 | 0.007324 | -0.009036 | 0.000000 |
3877.336000 | 0.159258 | -0.072270 | 0.035211 | -0.017266 | 0.006719 | 0.001748 | -0.008186 | 0.009760 | 0.012131 | -0.012355 | 0.000000 |
2143.841000 | 0.213872 | -0.107140 | 0.053123 | -0.026155 | 0.010184 | 0.002650 | -0.012374 | 0.014479 | 0.018143 | -0.024106 | 0.000000 |
1202.743000 | 0.242502 | -0.139516 | 0.071010 | -0.035192 | 0.013730 | 0.003573 | -0.016783 | 0.020247 | 0.025106 | -0.021419 | 0.000000 |
684.344300 | 0.195873 | -0.127894 | 0.067022 | -0.033441 | 0.013053 | 0.003398 | -0.015799 | 0.017920 | 0.022770 | -0.042191 | 0.000000 |
394.969400 | 0.096277 | -0.016162 | 0.003077 | -0.000907 | 0.000319 | 0.000080 | -0.000569 | 0.002384 | 0.002139 | 0.033136 | 0.000000 |
231.636900 | 0.018711 | 0.214937 | -0.161915 | 0.088153 | -0.035162 | -0.009174 | 0.043893 | -0.056489 | -0.069969 | 0.003560 | 0.000000 |
138.755600 | 0.002954 | 0.405176 | -0.373943 | 0.214619 | -0.086422 | -0.022593 | 0.105897 | -0.118700 | -0.155321 | 0.354662 | 0.000000 |
84.455420 | -0.001557 | 0.356336 | -0.405306 | 0.245620 | -0.100474 | -0.026294 | 0.128997 | -0.174008 | -0.212059 | -0.112104 | 0.000000 |
52.248430 | 0.001735 | 0.147112 | -0.109655 | 0.071879 | -0.030487 | -0.008062 | 0.030303 | -0.000747 | -0.039025 | 0.859122 | 0.000000 |
34.364580 | -0.001634 | 0.026445 | 0.366790 | -0.327894 | 0.147076 | 0.039064 | -0.174696 | 0.144687 | 0.220286 | -1.592460 | 0.000000 |
22.041580 | 0.001076 | 0.004126 | 0.604821 | -0.725319 | 0.348752 | 0.093166 | -0.520131 | 0.824431 | 1.314700 | -0.566366 | 0.000000 |
13.647670 | -0.000636 | -0.000231 | 0.361111 | -0.443395 | 0.204567 | 0.054472 | -0.251589 | 0.200382 | 0.134851 | -1.261060 | 0.000000 |
7.937987 | 0.000377 | -0.000019 | 0.068761 | 0.390346 | -0.243659 | -0.066767 | 0.554226 | -0.959157 | -2.353130 | 8.400510 | 0.000000 |
4.732444 | -0.000240 | -0.000134 | 0.001702 | 0.754970 | -0.594599 | -0.171770 | 1.025960 | -1.921480 | -2.882510 | -6.530260 | 0.000000 |
2.775613 | 0.000148 | 0.000013 | 0.002039 | 0.363586 | -0.441308 | -0.136211 | 0.432222 | 1.411920 | 8.052830 | -7.449230 | 0.000000 |
1.601232 | -0.000086 | -0.000010 | -0.000624 | 0.050680 | 0.166233 | 0.060491 | -1.815970 | 2.884400 | -2.478470 | 16.515800 | 0.000000 |
0.887714 | 0.000049 | 0.000011 | 0.000280 | 0.002908 | 0.634381 | 0.237033 | -0.806197 | -1.737900 | -5.591010 | -10.921000 | 0.000000 |
0.491740 | -0.000029 | -0.000002 | -0.000209 | 0.000347 | 0.500884 | 0.303480 | 0.730220 | -2.144450 | 4.403800 | -1.050190 | 0.000000 |
0.264746 | 0.000016 | 0.000002 | 0.000099 | 0.000214 | 0.116008 | 0.169864 | 0.826470 | 0.675547 | 1.877530 | 6.904640 | 0.000000 |
0.143345 | -0.000009 | -0.000001 | -0.000055 | -0.000063 | 0.003018 | -0.185887 | 0.532954 | 1.901390 | -2.963290 | -3.589170 | 0.000000 |
0.072523 | 0.000004 | 0.000001 | 0.000025 | 0.000034 | 0.001209 | -0.520730 | -0.355849 | -0.298108 | -0.122781 | -0.934770 | 0.000000 |
0.037358 | -0.000002 | -0.000000 | -0.000010 | -0.000014 | -0.000296 | -0.455713 | -0.430112 | -0.692964 | 0.773722 | 1.009460 | 0.000000 |
0.019159 | 0.000000 | 0.000000 | 0.000002 | 0.000003 | 0.000073 | -0.099131 | -0.094776 | -0.152492 | 0.155612 | 0.159772 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)