MOLPRO Basis Query, element=Pr, basis=cc-pVQZ-X2C, l=d
Basis Pr d cc-pVQZ-X2C
Primitives | Contractions... |
27900.310000 | 0.000012 | -0.000006 | 0.000001 | -0.000002 | 0.000002 | 0.000001 | 0.000002 | 0.000000 |
6958.605000 | 0.000094 | -0.000042 | 0.000011 | -0.000017 | 0.000022 | 0.000037 | 0.000037 | 0.000000 |
2415.691000 | 0.000543 | -0.000244 | 0.000064 | -0.000101 | 0.000098 | 0.000049 | 0.000103 | 0.000000 |
996.450200 | 0.002592 | -0.001168 | 0.000308 | -0.000472 | 0.000609 | 0.000987 | 0.000984 | 0.000000 |
458.454300 | 0.010369 | -0.004700 | 0.001239 | -0.001948 | 0.001930 | 0.001181 | 0.002088 | 0.000000 |
227.159300 | 0.033953 | -0.015507 | 0.004089 | -0.006285 | 0.007987 | 0.012516 | 0.012689 | 0.000000 |
118.315000 | 0.090342 | -0.041882 | 0.011071 | -0.017351 | 0.017122 | 0.010412 | 0.018310 | 0.000000 |
63.970780 | 0.188600 | -0.088426 | 0.023388 | -0.035912 | 0.047088 | 0.078372 | 0.078978 | 0.000000 |
35.359970 | 0.294724 | -0.135260 | 0.035727 | -0.057266 | 0.051954 | 0.007776 | 0.043106 | 0.000000 |
19.842880 | 0.324626 | -0.133823 | 0.034705 | -0.053641 | 0.095906 | 0.235919 | 0.240168 | 0.000000 |
11.217630 | 0.209769 | 0.011309 | -0.008398 | 0.004770 | -0.059621 | -0.292190 | -0.225197 | 0.000000 |
6.294840 | 0.064783 | 0.263873 | -0.082766 | 0.146437 | -0.106165 | 0.200826 | -0.161733 | 0.000000 |
3.468489 | 0.004288 | 0.415637 | -0.129079 | 0.192377 | -0.432301 | -1.359000 | -1.594390 | 0.000000 |
1.885576 | -0.002303 | 0.319488 | -0.083410 | 0.285435 | -0.114113 | 1.731520 | 4.294200 | 0.000000 |
0.988986 | -0.000978 | 0.117249 | 0.103685 | -0.614533 | 1.521990 | 0.258145 | -4.517680 | 0.000000 |
0.474760 | -0.000116 | 0.014630 | 0.334180 | -0.617404 | -0.911192 | -2.069940 | 2.747350 | 0.000000 |
0.217601 | -0.000002 | 0.000297 | 0.427517 | 0.373310 | -0.705972 | 1.995460 | -0.801013 | 0.000000 |
0.095508 | 0.000002 | 0.000172 | 0.294967 | 0.499770 | 0.726400 | -0.609539 | -0.576733 | 0.000000 |
0.039697 | 0.000000 | -0.000018 | 0.074770 | 0.127804 | 0.220253 | -0.389615 | 0.771185 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
|