MOLPRO Basis Query, element=Gd, basis=cc-pwCVQZ-X2C, l=p
Basis Gd p cc-pwCVQZ-X2C
| Primitives | Contractions... |
|---|
| 45772940.000000 | 0.000003 | -0.000002 | 0.000001 | -0.000000 | 0.000000 | 0.000000 | -0.000000 | -0.000001 | -0.000001 | 0.000000 | 0.000000 | 0.000000 |
| 11267910.000000 | 0.000005 | -0.000004 | 0.000001 | -0.000001 | 0.000000 | 0.000000 | -0.000001 | -0.000001 | -0.000001 | 0.000000 | 0.000000 | 0.000000 |
| 3184119.000000 | 0.000016 | -0.000013 | 0.000004 | -0.000002 | 0.000000 | 0.000001 | -0.000002 | -0.000003 | -0.000003 | 0.000000 | 0.000000 | 0.000000 |
| 995659.100000 | 0.000038 | -0.000031 | 0.000009 | -0.000004 | 0.000001 | 0.000003 | -0.000005 | -0.000007 | -0.000008 | 0.000000 | 0.000000 | 0.000000 |
| 336900.200000 | 0.000096 | -0.000079 | 0.000022 | -0.000010 | 0.000002 | 0.000007 | -0.000012 | -0.000018 | -0.000019 | 0.000000 | 0.000000 | 0.000000 |
| 121817.400000 | 0.000238 | -0.000197 | 0.000055 | -0.000025 | 0.000006 | 0.000019 | -0.000030 | -0.000045 | -0.000047 | 0.000000 | 0.000000 | 0.000000 |
| 46758.250000 | 0.000610 | -0.000505 | 0.000142 | -0.000065 | 0.000014 | 0.000047 | -0.000078 | -0.000118 | -0.000125 | 0.000000 | 0.000000 | 0.000000 |
| 19008.050000 | 0.001587 | -0.001319 | 0.000370 | -0.000171 | 0.000038 | 0.000124 | -0.000203 | -0.000301 | -0.000314 | 0.000000 | 0.000000 | 0.000000 |
| 8177.681000 | 0.004194 | -0.003498 | 0.000985 | -0.000455 | 0.000101 | 0.000330 | -0.000540 | -0.000829 | -0.000881 | 0.000000 | 0.000000 | 0.000000 |
| 3714.540000 | 0.011009 | -0.009245 | 0.002615 | -0.001209 | 0.000268 | 0.000879 | -0.001431 | -0.002116 | -0.002200 | 0.000000 | 0.000000 | 0.000000 |
| 1772.283000 | 0.027987 | -0.023769 | 0.006778 | -0.003133 | 0.000693 | 0.002272 | -0.003720 | -0.005742 | -0.006134 | 0.000000 | 0.000000 | 0.000000 |
| 882.546100 | 0.066039 | -0.057231 | 0.016549 | -0.007643 | 0.001692 | 0.005560 | -0.009052 | -0.013325 | -0.013828 | 0.000000 | 0.000000 | 0.000000 |
| 455.643100 | 0.136195 | -0.121701 | 0.035942 | -0.016596 | 0.003675 | 0.012043 | -0.019759 | -0.030832 | -0.033184 | 0.000000 | 0.000000 | 0.000000 |
| 242.103500 | 0.226722 | -0.211337 | 0.064226 | -0.029622 | 0.006561 | 0.021590 | -0.035114 | -0.050959 | -0.052450 | 0.000000 | 0.000000 | 0.000000 |
| 131.730000 | 0.271807 | -0.258502 | 0.079656 | -0.036758 | 0.008145 | 0.026644 | -0.044033 | -0.072081 | -0.079784 | 0.000000 | 0.000000 | 0.000000 |
| 72.750220 | 0.209137 | -0.120913 | 0.018442 | -0.008471 | 0.001839 | 0.006256 | -0.008929 | 0.000162 | 0.011370 | 0.000000 | 0.000000 | 0.000000 |
| 40.529360 | 0.126833 | 0.216576 | -0.151772 | 0.070180 | -0.015714 | -0.053000 | 0.086902 | 0.111941 | 0.100814 | 0.000000 | 0.000000 | 0.000000 |
| 23.077400 | 0.113327 | 0.472143 | -0.334250 | 0.158456 | -0.035718 | -0.118068 | 0.204723 | 0.400973 | 0.529523 | 0.000000 | 0.000000 | 0.000000 |
| 13.357750 | 0.075565 | 0.335121 | -0.204554 | 0.090204 | -0.020069 | -0.071264 | 0.113252 | 0.058683 | -0.049862 | 1.000000 | 0.000000 | 0.000000 |
| 7.753092 | 0.019950 | 0.081698 | 0.243246 | -0.141446 | 0.033633 | 0.135126 | -0.272785 | -0.478933 | -0.744969 | 0.000000 | 1.000000 | 0.000000 |
| 4.398293 | 0.000096 | -0.015333 | 0.529606 | -0.319748 | 0.077615 | 0.256000 | -0.483325 | -1.254350 | -1.849510 | 0.000000 | 0.000000 | 0.000000 |
| 2.486183 | -0.001350 | -0.016007 | 0.352135 | -0.237032 | 0.057653 | 0.236295 | -0.285821 | 1.218060 | 4.925850 | 0.000000 | 0.000000 | 0.000000 |
| 1.373227 | -0.000296 | -0.004048 | 0.092384 | 0.124989 | -0.043922 | -0.391216 | 1.174980 | 1.872790 | -3.105330 | 0.000000 | 0.000000 | 0.000000 |
| 0.742075 | -0.000088 | -0.000812 | 0.026983 | 0.437216 | -0.135232 | -0.542393 | 0.546712 | -2.444240 | -1.831940 | 0.000000 | 0.000000 | 0.000000 |
| 0.400243 | -0.000024 | -0.000506 | 0.021409 | 0.430484 | -0.163513 | -0.029079 | -0.995345 | -0.423685 | 4.099000 | 0.000000 | 0.000000 | 0.000000 |
| 0.212732 | -0.000022 | -0.000211 | 0.008820 | 0.187996 | -0.078553 | 0.312346 | -0.716894 | 1.625890 | -1.921610 | 0.000000 | 0.000000 | 0.000000 |
| 0.102107 | 0.000002 | -0.000026 | 0.001309 | 0.027024 | 0.209404 | 0.526926 | 0.558208 | -0.021959 | -0.936070 | 0.000000 | 0.000000 | 0.000000 |
| 0.050606 | -0.000002 | -0.000001 | 0.000010 | 0.001074 | 0.495231 | 0.254667 | 0.489259 | -0.685508 | 1.070790 | 0.000000 | 0.000000 | 0.000000 |
| 0.025306 | 0.000001 | -0.000000 | 0.000050 | 0.000780 | 0.379290 | 0.026751 | 0.031717 | -0.012813 | 0.014511 | 0.000000 | 0.000000 | 0.000000 |
| 0.012605 | -0.000000 | -0.000000 | -0.000010 | -0.000121 | 0.071097 | 0.000880 | 0.006215 | -0.017018 | 0.032031 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
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