MOLPRO Basis Query, element=Er, basis=cc-pVTZ-DK3, l=d
Basis Er d cc-pVTZ-DK3
Primitives | Contractions... |
13207.390000 | 0.000098 | -0.000045 | -0.000010 | 0.000020 | -0.000026 | -0.000035 | 0.000000 |
3391.393000 | 0.000745 | -0.000348 | -0.000075 | 0.000156 | -0.000241 | -0.000237 | 0.000000 |
1202.594000 | 0.004243 | -0.001987 | -0.000429 | 0.000858 | -0.001109 | -0.001537 | 0.000000 |
503.268500 | 0.018902 | -0.008929 | -0.001933 | 0.004010 | -0.006115 | -0.006114 | 0.000000 |
232.595200 | 0.064874 | -0.030998 | -0.006709 | 0.013416 | -0.017473 | -0.024028 | 0.000000 |
114.660000 | 0.168159 | -0.081993 | -0.017819 | 0.037027 | -0.057095 | -0.056054 | 0.000000 |
58.922040 | 0.307924 | -0.148545 | -0.032167 | 0.064043 | -0.079079 | -0.118924 | 0.000000 |
31.053330 | 0.367763 | -0.159968 | -0.034309 | 0.075549 | -0.140314 | -0.112439 | 0.000000 |
16.571540 | 0.230620 | 0.026582 | 0.011170 | -0.033331 | 0.111081 | -0.000245 | 0.000000 |
8.713027 | 0.055466 | 0.346068 | 0.087067 | -0.169659 | 0.230782 | 0.785819 | 0.000000 |
4.458206 | -0.001590 | 0.462751 | 0.115808 | -0.304779 | 0.648480 | -0.063698 | 0.000000 |
2.198460 | -0.002788 | 0.261327 | 0.018156 | 0.077959 | -1.209060 | -1.652210 | 0.000000 |
0.980454 | -0.000600 | 0.048458 | -0.210913 | 0.848167 | -0.105368 | 2.040690 | 0.000000 |
0.401599 | 0.000031 | 0.000655 | -0.420952 | 0.027650 | 1.113250 | -1.144940 | 0.000000 |
0.153061 | -0.000015 | 0.000666 | -0.432196 | -0.549858 | -0.518090 | -0.078561 | 0.000000 |
0.054200 | 0.000006 | -0.000133 | -0.193127 | -0.234747 | -0.295681 | 0.582198 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys 145, 054111 (2016)