MOLPRO Basis Query, element=U, basis=cc-pwCVQZ-DK3, l=s
Basis U s cc-pwCVQZ-DK3
| Primitives | Contractions... |
|---|
| 56697466.000000 | -0.001259 | 0.001776 | -0.000790 | -0.000123 | 0.000109 | -0.000049 | 0.000022 | 0.000041 | 0.000053 | 0.000068 | 0.000072 | 0.000000 | 0.000000 | 0.000000 |
| 15093688.000000 | -0.001093 | 0.001542 | -0.000685 | -0.000107 | 0.000095 | -0.000043 | 0.000019 | 0.000036 | 0.000046 | 0.000059 | 0.000063 | 0.000000 | 0.000000 | 0.000000 |
| 5164101.300000 | -0.003164 | 0.004461 | -0.001986 | -0.000309 | 0.000274 | -0.000124 | 0.000056 | 0.000103 | 0.000134 | 0.000170 | 0.000182 | 0.000000 | 0.000000 | 0.000000 |
| 1964638.800000 | -0.003892 | 0.005480 | -0.002447 | -0.000381 | 0.000338 | -0.000152 | 0.000069 | 0.000128 | 0.000165 | 0.000210 | 0.000225 | 0.000000 | 0.000000 | 0.000000 |
| 820774.810000 | -0.007685 | 0.010793 | -0.004844 | -0.000756 | 0.000670 | -0.000302 | 0.000136 | 0.000253 | 0.000327 | 0.000415 | 0.000445 | 0.000000 | 0.000000 | 0.000000 |
| 364106.970000 | -0.010422 | 0.014574 | -0.006599 | -0.001032 | 0.000913 | -0.000412 | 0.000185 | 0.000345 | 0.000447 | 0.000567 | 0.000607 | 0.000000 | 0.000000 | 0.000000 |
| 170668.080000 | -0.017763 | 0.024702 | -0.011311 | -0.001773 | 0.001568 | -0.000707 | 0.000318 | 0.000592 | 0.000767 | 0.000970 | 0.001044 | 0.000000 | 0.000000 | 0.000000 |
| 83455.390000 | -0.024716 | 0.034055 | -0.015888 | -0.002502 | 0.002210 | -0.000996 | 0.000448 | 0.000834 | 0.001082 | 0.001374 | 0.001466 | 0.000000 | 0.000000 | 0.000000 |
| 42423.377000 | -0.039140 | 0.053315 | -0.025448 | -0.004030 | 0.003552 | -0.001602 | 0.000720 | 0.001340 | 0.001734 | 0.002190 | 0.002373 | 0.000000 | 0.000000 | 0.000000 |
| 22228.774000 | -0.054697 | 0.073131 | -0.036221 | -0.005787 | 0.005084 | -0.002293 | 0.001031 | 0.001920 | 0.002494 | 0.003183 | 0.003359 | 0.000000 | 0.000000 | 0.000000 |
| 11931.713000 | -0.082351 | 0.107521 | -0.055782 | -0.009014 | 0.007888 | -0.003557 | 0.001600 | 0.002975 | 0.003841 | 0.004818 | 0.005310 | 0.000000 | 0.000000 | 0.000000 |
| 6539.042000 | -0.109230 | 0.137288 | -0.076647 | -0.012600 | 0.010958 | -0.004943 | 0.002223 | 0.004145 | 0.005406 | 0.006987 | 0.007160 | 0.000000 | 0.000000 | 0.000000 |
| 3678.232700 | -0.140348 | 0.168406 | -0.102563 | -0.017222 | 0.014873 | -0.006709 | 0.003017 | 0.005601 | 0.007172 | 0.008767 | 0.010264 | 0.000000 | 0.000000 | 0.000000 |
| 2139.549400 | -0.139899 | 0.158805 | -0.107127 | -0.018396 | 0.015756 | -0.007110 | 0.003197 | 0.005995 | 0.007984 | 0.010945 | 0.009677 | 0.000000 | 0.000000 | 0.000000 |
| 1288.453300 | -0.114982 | 0.134622 | -0.085067 | -0.014291 | 0.012353 | -0.005568 | 0.002504 | 0.004570 | 0.005437 | 0.005037 | 0.010086 | 0.000000 | 0.000000 | 0.000000 |
| 792.077180 | -0.026748 | 0.080110 | 0.013539 | 0.006711 | -0.004531 | 0.002051 | -0.000924 | -0.001546 | -0.001047 | 0.002375 | -0.007021 | 0.000000 | 0.000000 | 0.000000 |
| 484.699320 | 0.086554 | 0.071713 | 0.207313 | 0.057137 | -0.042834 | 0.019429 | -0.008745 | -0.016695 | -0.023641 | -0.037589 | -0.022278 | 0.000000 | 0.000000 | 0.000000 |
| 298.001270 | 0.189843 | 0.066335 | 0.464767 | 0.142655 | -0.105093 | 0.047705 | -0.021483 | -0.039417 | -0.047492 | -0.046148 | -0.086879 | 0.000000 | 0.000000 | 0.000000 |
| 186.739590 | 0.148694 | 0.067458 | 0.511739 | 0.180041 | -0.129134 | 0.058855 | -0.026512 | -0.051123 | -0.074399 | -0.124569 | -0.064002 | 0.000000 | 0.000000 | 0.000000 |
| 120.332380 | 0.106037 | 0.031347 | 0.265477 | 0.093111 | -0.069415 | 0.031779 | -0.014346 | -0.024130 | -0.017587 | 0.029060 | -0.090133 | 0.000000 | 0.000000 | 0.000000 |
| 75.850314 | 0.145366 | 0.051015 | -0.262306 | -0.239550 | 0.165302 | -0.077278 | 0.035014 | 0.061437 | 0.057560 | -0.011074 | 0.196025 | 0.000000 | 0.000000 | 0.000000 |
| 49.223121 | 0.232102 | 0.060345 | -0.632443 | -0.643426 | 0.460856 | -0.218721 | 0.099253 | 0.197394 | 0.302205 | 0.547561 | 0.326782 | 0.000000 | 0.000000 | 0.000000 |
| 30.979370 | 0.159628 | 0.049383 | -0.465682 | -0.533877 | 0.380468 | -0.180440 | 0.081968 | 0.144341 | 0.133814 | -0.044535 | 0.340291 | 0.000000 | 0.000000 | 0.000000 |
| 19.338986 | 0.040759 | 0.008938 | -0.070009 | 0.221111 | -0.180147 | 0.085409 | -0.038822 | -0.066301 | -0.026591 | 0.233014 | -0.402055 | 0.000000 | 0.000000 | 0.000000 |
| 11.909179 | -0.001686 | 0.002118 | 0.096551 | 0.808713 | -0.942969 | 0.533791 | -0.249936 | -0.521656 | -0.849950 | -1.755850 | -1.301420 | 0.000000 | 0.000000 | 0.000000 |
| 7.281087 | -0.002275 | -0.001769 | 0.063923 | 0.460027 | -0.745365 | 0.435069 | -0.204527 | -0.381255 | -0.327723 | 0.689368 | 0.150209 | 1.000000 | 0.000000 | 0.000000 |
| 4.523816 | -0.000568 | 0.000918 | 0.008350 | 0.082279 | 0.346623 | -0.279036 | 0.136093 | 0.306336 | 0.333063 | -1.092140 | -0.391779 | 0.000000 | 1.000000 | 0.000000 |
| 2.691479 | 0.000400 | -0.000596 | 0.001885 | 0.022967 | 0.843429 | -0.797416 | 0.409243 | 0.990160 | 1.909070 | 7.039860 | 11.410700 | 0.000000 | 0.000000 | 0.000000 |
| 1.643698 | 0.000043 | 0.000551 | -0.001491 | 0.004042 | 0.389935 | -0.518189 | 0.282652 | 0.890009 | 1.037280 | -6.236330 | -22.777900 | 0.000000 | 0.000000 | 0.000000 |
| 1.024666 | 0.000094 | -0.000338 | 0.000827 | 0.002985 | 0.080572 | 0.144799 | -0.104785 | -1.415880 | -4.426320 | -5.187130 | 14.539400 | 0.000000 | 0.000000 | 0.000000 |
| 0.608707 | -0.000032 | 0.000209 | -0.000530 | -0.001276 | 0.027544 | 0.586041 | -0.382493 | -1.324890 | -0.238746 | 9.219000 | 5.244800 | 0.000000 | 0.000000 | 0.000000 |
| 0.362155 | 0.000025 | -0.000122 | 0.000316 | 0.000481 | 0.020892 | 0.477662 | -0.420282 | 0.161349 | 3.080140 | -0.473828 | -12.214400 | 0.000000 | 0.000000 | 0.000000 |
| 0.212813 | -0.000010 | 0.000065 | -0.000166 | -0.000399 | 0.005578 | 0.133924 | -0.227285 | 0.889922 | 1.072530 | -4.653060 | 3.318690 | 0.000000 | 0.000000 | 0.000000 |
| 0.120510 | 0.000005 | -0.000030 | 0.000076 | 0.000148 | 0.001047 | 0.030580 | 0.085755 | 0.972733 | -1.980030 | 0.372771 | 5.034030 | 0.000000 | 0.000000 | 0.000000 |
| 0.064398 | -0.000002 | 0.000012 | -0.000030 | -0.000093 | 0.001017 | 0.082225 | 0.481323 | 0.034347 | -1.055380 | 2.489310 | -3.497460 | 0.000000 | 0.000000 | 0.000000 |
| 0.032841 | 0.000001 | -0.000004 | 0.000010 | -0.000013 | 0.001277 | 0.092502 | 0.546297 | -0.687918 | 0.791725 | -0.367023 | -1.099380 | 0.000000 | 0.000000 | 0.000000 |
| 0.016422 | -0.000000 | 0.000001 | -0.000002 | -0.000013 | 0.000297 | 0.022745 | 0.135083 | -0.306663 | 0.537662 | -0.820676 | 1.553570 | 0.000000 | 0.000000 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)