MOLPRO Basis Query, element=Bk, basis=cc-pwCVDZ-DK3, l=s
Basis Bk s cc-pwCVDZ-DK3
| Primitives | Contractions... |
|---|
| 55453696.000000 | 0.000562 | 0.002919 | 0.001102 | -0.000139 | 0.000176 | -0.000073 | 0.000028 | -0.000065 | 0.000000 | 0.000000 |
| 14622163.000000 | 0.000502 | 0.002602 | 0.000982 | -0.000124 | 0.000156 | -0.000065 | 0.000025 | -0.000058 | 0.000000 | 0.000000 |
| 4892261.600000 | 0.001401 | 0.007290 | 0.002756 | -0.000348 | 0.000439 | -0.000184 | 0.000071 | -0.000163 | 0.000000 | 0.000000 |
| 1789910.800000 | 0.001874 | 0.009794 | 0.003713 | -0.000469 | 0.000592 | -0.000247 | 0.000096 | -0.000220 | 0.000000 | 0.000000 |
| 702352.830000 | 0.003612 | 0.019040 | 0.007254 | -0.000918 | 0.001158 | -0.000484 | 0.000187 | -0.000431 | 0.000000 | 0.000000 |
| 286774.270000 | 0.005470 | 0.029269 | 0.011251 | -0.001428 | 0.001799 | -0.000752 | 0.000291 | -0.000668 | 0.000000 | 0.000000 |
| 121221.390000 | 0.009219 | 0.050502 | 0.019659 | -0.002509 | 0.003152 | -0.001318 | 0.000510 | -0.001175 | 0.000000 | 0.000000 |
| 52663.885000 | 0.014001 | 0.079851 | 0.031775 | -0.004086 | 0.005120 | -0.002141 | 0.000828 | -0.001896 | 0.000000 | 0.000000 |
| 23474.020000 | 0.021276 | 0.129334 | 0.053072 | -0.006919 | 0.008611 | -0.003599 | 0.001392 | -0.003224 | 0.000000 | 0.000000 |
| 10709.131000 | 0.028598 | 0.194862 | 0.084211 | -0.011169 | 0.013817 | -0.005778 | 0.002235 | -0.005083 | 0.000000 | 0.000000 |
| 4994.205000 | 0.032649 | 0.270351 | 0.125126 | -0.017134 | 0.020865 | -0.008717 | 0.003371 | -0.007904 | 0.000000 | 0.000000 |
| 2378.132600 | 0.027137 | 0.292146 | 0.145926 | -0.020340 | 0.024690 | -0.010324 | 0.003998 | -0.008820 | 0.000000 | 0.000000 |
| 1154.835200 | 0.044024 | 0.181959 | 0.049718 | -0.003974 | 0.006150 | -0.002562 | 0.000980 | -0.003160 | 0.000000 | 0.000000 |
| 559.175060 | 0.170172 | -0.034289 | -0.307711 | 0.076204 | -0.074992 | 0.031283 | -0.012085 | 0.030211 | 0.000000 | 0.000000 |
| 283.755190 | 0.264764 | -0.126974 | -0.729483 | 0.209620 | -0.200850 | 0.084102 | -0.032675 | 0.069934 | 0.000000 | 0.000000 |
| 147.748970 | 0.165316 | -0.080008 | -0.424955 | 0.135641 | -0.126166 | 0.053012 | -0.020371 | 0.059123 | 0.000000 | 0.000000 |
| 74.082821 | 0.230298 | -0.143823 | 0.676477 | -0.580774 | 0.500541 | -0.217359 | 0.084324 | -0.224600 | 0.000000 | 0.000000 |
| 39.561728 | 0.205685 | -0.131528 | 0.754884 | -0.740790 | 0.685198 | -0.307221 | 0.121157 | -0.238960 | 0.000000 | 0.000000 |
| 18.851564 | 0.032851 | -0.019442 | 0.005623 | 0.564440 | -0.717509 | 0.367610 | -0.148288 | 0.281981 | 0.000000 | 0.000000 |
| 10.309100 | -0.004707 | 0.004812 | -0.144188 | 0.780960 | -1.301900 | 0.751752 | -0.301865 | 0.898314 | 0.000000 | 0.000000 |
| 4.441739 | 0.001828 | -0.000914 | -0.014914 | 0.172498 | 0.763862 | -0.763603 | 0.325190 | -1.336170 | 1.000000 | 0.000000 |
| 2.337090 | 0.000066 | -0.000042 | -0.002030 | 0.061982 | 0.819770 | -0.838371 | 0.384064 | -0.529937 | 0.000000 | 0.000000 |
| 0.803872 | 0.000224 | -0.000132 | -0.000338 | 0.009786 | 0.077742 | 0.814679 | -0.482789 | 2.854410 | 0.000000 | 0.000000 |
| 0.356182 | -0.000060 | 0.000036 | -0.000053 | -0.000428 | 0.012283 | 0.557901 | -0.456433 | -2.048840 | 0.000000 | 0.000000 |
| 0.061824 | 0.000018 | -0.000010 | -0.000011 | 0.000485 | 0.002872 | 0.114054 | 0.776503 | -0.699149 | 0.000000 | 0.000000 |
| 0.025239 | -0.000008 | 0.000005 | 0.000000 | -0.000158 | -0.000195 | 0.045849 | 0.397803 | 1.082000 | 0.000000 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)