MOLPRO Basis Query, element=Gd, basis=cc-pwCVQZ-DK3, l=s
Basis Gd s cc-pwCVQZ-DK3
| Primitives | Contractions... |
|---|
| 69231600.000000 | 0.000316 | -0.000166 | 0.000093 | -0.000022 | 0.000011 | -0.000006 | -0.000010 | 0.000015 | 0.000019 | 0.000018 | 0.000000 | 0.000000 | 0.000000 |
| 18430150.000000 | 0.000310 | -0.000163 | 0.000091 | -0.000022 | 0.000011 | -0.000006 | -0.000010 | 0.000014 | 0.000018 | 0.000018 | 0.000000 | 0.000000 | 0.000000 |
| 6323406.000000 | 0.000892 | -0.000469 | 0.000263 | -0.000062 | 0.000032 | -0.000016 | -0.000029 | 0.000042 | 0.000053 | 0.000051 | 0.000000 | 0.000000 | 0.000000 |
| 2418291.000000 | 0.001244 | -0.000655 | 0.000367 | -0.000087 | 0.000045 | -0.000022 | -0.000041 | 0.000058 | 0.000074 | 0.000071 | 0.000000 | 0.000000 | 0.000000 |
| 1011436.000000 | 0.002479 | -0.001307 | 0.000734 | -0.000174 | 0.000091 | -0.000045 | -0.000082 | 0.000116 | 0.000147 | 0.000141 | 0.000000 | 0.000000 | 0.000000 |
| 446835.300000 | 0.003837 | -0.002029 | 0.001141 | -0.000271 | 0.000141 | -0.000070 | -0.000127 | 0.000180 | 0.000229 | 0.000221 | 0.000000 | 0.000000 | 0.000000 |
| 206587.200000 | 0.006798 | -0.003607 | 0.002033 | -0.000483 | 0.000251 | -0.000124 | -0.000226 | 0.000322 | 0.000409 | 0.000391 | 0.000000 | 0.000000 | 0.000000 |
| 98757.810000 | 0.010964 | -0.005848 | 0.003308 | -0.000786 | 0.000409 | -0.000202 | -0.000368 | 0.000523 | 0.000664 | 0.000644 | 0.000000 | 0.000000 | 0.000000 |
| 48564.430000 | 0.018741 | -0.010070 | 0.005723 | -0.001363 | 0.000709 | -0.000350 | -0.000638 | 0.000909 | 0.001159 | 0.001097 | 0.000000 | 0.000000 | 0.000000 |
| 24424.960000 | 0.031004 | -0.016854 | 0.009652 | -0.002304 | 0.001198 | -0.000591 | -0.001078 | 0.001532 | 0.001939 | 0.001903 | 0.000000 | 0.000000 | 0.000000 |
| 12525.380000 | 0.052422 | -0.028982 | 0.016781 | -0.004021 | 0.002090 | -0.001032 | -0.001883 | 0.002685 | 0.003434 | 0.003205 | 0.000000 | 0.000000 | 0.000000 |
| 6537.632000 | 0.085961 | -0.048841 | 0.028769 | -0.006933 | 0.003602 | -0.001779 | -0.003243 | 0.004605 | 0.005805 | 0.005799 | 0.000000 | 0.000000 | 0.000000 |
| 3471.048000 | 0.136025 | -0.080694 | 0.048812 | -0.011874 | 0.006166 | -0.003045 | -0.005560 | 0.007939 | 0.010212 | 0.009324 | 0.000000 | 0.000000 | 0.000000 |
| 1873.554000 | 0.193348 | -0.123390 | 0.077854 | -0.019221 | 0.009969 | -0.004923 | -0.008976 | 0.012727 | 0.015944 | 0.016461 | 0.000000 | 0.000000 | 0.000000 |
| 1027.361000 | 0.227593 | -0.163082 | 0.109533 | -0.027685 | 0.014339 | -0.007082 | -0.012954 | 0.018581 | 0.024239 | 0.020901 | 0.000000 | 0.000000 | 0.000000 |
| 571.513300 | 0.190252 | -0.157236 | 0.113437 | -0.029501 | 0.015242 | -0.007528 | -0.013714 | 0.019297 | 0.023394 | 0.027892 | 0.000000 | 0.000000 | 0.000000 |
| 321.848900 | 0.099415 | -0.050262 | 0.026690 | -0.006121 | 0.003205 | -0.001585 | -0.002957 | 0.004715 | 0.008588 | -0.003230 | 0.000000 | 0.000000 | 0.000000 |
| 182.064800 | 0.054208 | 0.163764 | -0.217086 | 0.071028 | -0.036311 | 0.017969 | 0.033252 | -0.049035 | -0.069352 | -0.042743 | 0.000000 | 0.000000 | 0.000000 |
| 105.292600 | 0.066112 | 0.315138 | -0.516696 | 0.191035 | -0.097273 | 0.048177 | 0.088649 | -0.125333 | -0.150568 | -0.205688 | 0.000000 | 0.000000 | 0.000000 |
| 61.644590 | 0.049466 | 0.235842 | -0.511810 | 0.212809 | -0.108578 | 0.053914 | 0.101626 | -0.154176 | -0.229444 | -0.097879 | 0.000000 | 0.000000 | 0.000000 |
| 36.488220 | 0.021952 | 0.111643 | -0.050206 | 0.008712 | -0.005762 | 0.002929 | 0.001647 | 0.014924 | 0.073174 | -0.268777 | 0.000000 | 0.000000 | 0.000000 |
| 23.119500 | 0.020280 | 0.137792 | 0.484645 | -0.398442 | 0.212277 | -0.107039 | -0.195641 | 0.253841 | 0.236435 | 1.006720 | 0.000000 | 0.000000 | 0.000000 |
| 15.042880 | 0.021537 | 0.142117 | 0.546843 | -0.605908 | 0.334791 | -0.170524 | -0.373815 | 0.694130 | 1.383720 | 0.523030 | 0.000000 | 0.000000 | 0.000000 |
| 9.682888 | 0.010773 | 0.075513 | 0.297632 | -0.301540 | 0.155237 | -0.077737 | -0.124240 | 0.043494 | -0.556175 | 0.489172 | 0.000000 | 0.000000 | 0.000000 |
| 5.766888 | 0.002072 | 0.012069 | 0.030547 | 0.381287 | -0.244639 | 0.127701 | 0.351680 | -0.669862 | -0.853703 | -4.096420 | 0.000000 | 0.000000 | 0.000000 |
| 3.535186 | -0.000646 | -0.004255 | -0.041861 | 0.683846 | -0.569287 | 0.316273 | 0.780069 | -1.592870 | -4.335110 | -1.032370 | 0.000000 | 0.000000 | 0.000000 |
| 2.117304 | -0.000113 | -0.001752 | -0.020067 | 0.339275 | -0.428867 | 0.250789 | 0.524685 | 0.169514 | 7.082430 | 11.835200 | 0.000000 | 0.000000 | 0.000000 |
| 1.220142 | -0.000117 | -0.000538 | -0.004251 | 0.065663 | 0.118435 | -0.086681 | -1.254180 | 3.289980 | 0.362469 | -12.702700 | 0.000000 | 0.000000 | 0.000000 |
| 0.693518 | 0.000028 | -0.000042 | -0.001022 | 0.042434 | 0.542100 | -0.376682 | -1.004950 | -0.568621 | -6.252340 | 2.100110 | 0.000000 | 0.000000 | 0.000000 |
| 0.392100 | -0.000036 | -0.000148 | -0.001172 | 0.033877 | 0.425366 | -0.406795 | 0.328869 | -2.314480 | 2.047770 | 6.482570 | 0.000000 | 0.000000 | 0.000000 |
| 0.221820 | 0.000013 | 0.000009 | -0.000127 | 0.007731 | 0.082962 | -0.227107 | 0.592732 | -0.606433 | 3.102650 | -3.672800 | 0.000000 | 0.000000 | 0.000000 |
| 0.129745 | -0.000008 | -0.000019 | -0.000088 | 0.001518 | 0.034210 | 0.092726 | 0.877862 | 1.712220 | -1.110880 | -2.893690 | 0.000000 | 0.000000 | 0.000000 |
| 0.064594 | 0.000002 | -0.000002 | -0.000052 | 0.003644 | 0.122019 | 0.476950 | 0.113229 | 0.833023 | -1.717920 | 3.190040 | 0.000000 | 0.000000 | 0.000000 |
| 0.032637 | -0.000002 | -0.000010 | -0.000084 | 0.003976 | 0.132758 | 0.523226 | -0.652534 | -0.728275 | 0.491339 | 0.331889 | 0.000000 | 0.000000 | 0.000000 |
| 0.016207 | 0.000000 | -0.000001 | -0.000016 | 0.000919 | 0.030867 | 0.122136 | -0.298271 | -0.457315 | 0.594030 | -1.220600 | 1.000000 | 0.000000 | 0.000000 |
| 12.332830 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 7.789695 | 0.000000 | 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)