MOLPRO Basis Query, element=Er, basis=cc-pVDZ-X2C, l=p
Basis Er p cc-pVDZ-X2C
Primitives | Contractions... |
2936576.000000 | 0.000040 | -0.000033 | 0.000009 | -0.000004 | 0.000001 | 0.000003 | 0.000000 |
427036.300000 | 0.000163 | -0.000136 | 0.000039 | -0.000017 | 0.000004 | 0.000014 | 0.000000 |
88273.150000 | 0.000637 | -0.000531 | 0.000152 | -0.000067 | 0.000014 | 0.000054 | 0.000000 |
22663.300000 | 0.002420 | -0.002025 | 0.000580 | -0.000258 | 0.000055 | 0.000209 | 0.000000 |
6923.044000 | 0.008951 | -0.007547 | 0.002171 | -0.000963 | 0.000204 | 0.000772 | 0.000000 |
2438.775000 | 0.031018 | -0.026449 | 0.007674 | -0.003417 | 0.000726 | 0.002772 | 0.000000 |
959.443300 | 0.093718 | -0.082162 | 0.024284 | -0.010756 | 0.002281 | 0.008604 | 0.000000 |
409.767200 | 0.220424 | -0.201279 | 0.061207 | -0.027257 | 0.005797 | 0.022243 | 0.000000 |
185.594500 | 0.338951 | -0.326800 | 0.102915 | -0.045339 | 0.009606 | 0.035888 | 0.000000 |
87.487830 | 0.273489 | -0.170936 | 0.032287 | -0.015167 | 0.003260 | 0.014083 | 0.000000 |
41.499560 | 0.155892 | 0.377477 | -0.264000 | 0.120694 | -0.026106 | -0.105896 | 0.000000 |
20.535210 | 0.128798 | 0.581025 | -0.417894 | 0.184063 | -0.039282 | -0.142881 | 0.000000 |
9.888865 | 0.037917 | 0.159355 | 0.219437 | -0.120664 | 0.026835 | 0.098465 | 0.000000 |
4.795825 | -0.002703 | -0.030297 | 0.687787 | -0.425792 | 0.099315 | 0.462394 | 0.000000 |
2.263246 | -0.000587 | -0.011426 | 0.288503 | -0.081234 | 0.012484 | -0.142781 | 0.000000 |
0.886892 | -0.000326 | -0.002086 | 0.039568 | 0.597277 | -0.173291 | -0.876741 | 0.000000 |
0.355326 | 0.000043 | -0.000192 | 0.020250 | 0.521554 | -0.201280 | 0.426772 | 0.000000 |
0.095224 | -0.000030 | -0.000144 | 0.002226 | 0.055288 | 0.374676 | 0.739188 | 0.000000 |
0.032745 | 0.000010 | 0.000042 | -0.000336 | -0.007794 | 0.749610 | 0.058371 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
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