MOLPRO Basis Query, element=Er, basis=cc-pVTZ-DK3, l=s
Basis Er s cc-pVTZ-DK3
| Primitives | Contractions... |
|---|
| 66748150.000000 | 0.000417 | -0.000214 | 0.000125 | -0.000030 | 0.000015 | -0.000007 | -0.000014 | 0.000021 | 0.000025 | 0.000000 |
| 17661890.000000 | 0.000417 | -0.000214 | 0.000125 | -0.000030 | 0.000015 | -0.000007 | -0.000014 | 0.000021 | 0.000025 | 0.000000 |
| 5975533.000000 | 0.001182 | -0.000607 | 0.000354 | -0.000086 | 0.000044 | -0.000019 | -0.000039 | 0.000058 | 0.000072 | 0.000000 |
| 2230385.000000 | 0.001742 | -0.000897 | 0.000523 | -0.000127 | 0.000065 | -0.000029 | -0.000057 | 0.000086 | 0.000107 | 0.000000 |
| 898515.100000 | 0.003485 | -0.001797 | 0.001050 | -0.000255 | 0.000130 | -0.000057 | -0.000115 | 0.000173 | 0.000213 | 0.000000 |
| 378856.600000 | 0.005757 | -0.002978 | 0.001744 | -0.000424 | 0.000216 | -0.000095 | -0.000191 | 0.000288 | 0.000358 | 0.000000 |
| 166038.500000 | 0.010426 | -0.005419 | 0.003182 | -0.000775 | 0.000394 | -0.000174 | -0.000347 | 0.000524 | 0.000643 | 0.000000 |
| 75036.100000 | 0.017795 | -0.009318 | 0.005497 | -0.001341 | 0.000681 | -0.000302 | -0.000605 | 0.000913 | 0.001140 | 0.000000 |
| 34882.210000 | 0.031305 | -0.016577 | 0.009846 | -0.002407 | 0.001222 | -0.000541 | -0.001075 | 0.001624 | 0.001972 | 0.000000 |
| 16637.790000 | 0.053789 | -0.028993 | 0.017403 | -0.004272 | 0.002171 | -0.000962 | -0.001938 | 0.002923 | 0.003694 | 0.000000 |
| 8128.794000 | 0.091934 | -0.050968 | 0.031108 | -0.007679 | 0.003897 | -0.001723 | -0.003405 | 0.005150 | 0.006152 | 0.000000 |
| 4061.319000 | 0.148631 | -0.086344 | 0.054112 | -0.013504 | 0.006856 | -0.003039 | -0.006173 | 0.009305 | 0.012013 | 0.000000 |
| 2071.658000 | 0.215663 | -0.135640 | 0.088748 | -0.022482 | 0.011383 | -0.005027 | -0.009829 | 0.014903 | 0.017207 | 0.000000 |
| 1076.701000 | 0.247284 | -0.176888 | 0.123409 | -0.032149 | 0.016295 | -0.007241 | -0.015016 | 0.022594 | 0.030807 | 0.000000 |
| 568.322900 | 0.186948 | -0.149548 | 0.110556 | -0.029425 | 0.014803 | -0.006491 | -0.011827 | 0.018160 | 0.016115 | 0.000000 |
| 302.878900 | 0.081561 | 0.021823 | -0.048137 | 0.016579 | -0.008120 | 0.003455 | 0.004384 | -0.007366 | 0.005046 | 0.000000 |
| 164.768600 | 0.059985 | 0.279155 | -0.399109 | 0.141688 | -0.071142 | 0.031893 | 0.070088 | -0.105664 | -0.164895 | 0.000000 |
| 91.064360 | 0.064190 | 0.325619 | -0.636478 | 0.257433 | -0.127736 | 0.056092 | 0.102502 | -0.160530 | -0.136051 | 0.000000 |
| 50.798760 | 0.030484 | 0.161124 | -0.262642 | 0.115142 | -0.060410 | 0.028362 | 0.081007 | -0.120029 | -0.296627 | 0.000000 |
| 28.113050 | 0.023746 | 0.173436 | 0.567879 | -0.475564 | 0.251717 | -0.116352 | -0.289818 | 0.447807 | 0.873063 | 0.000000 |
| 16.100750 | 0.021876 | 0.171160 | 0.674849 | -0.785738 | 0.421062 | -0.187042 | -0.355241 | 0.669436 | 0.670533 | 0.000000 |
| 9.071022 | 0.006093 | 0.046432 | 0.175810 | 0.032746 | -0.032137 | 0.009113 | -0.024023 | -0.181643 | -0.149579 | 0.000000 |
| 4.878704 | -0.000240 | -0.002742 | -0.040996 | 0.834759 | -0.625232 | 0.312521 | 1.042120 | -2.066790 | -4.989910 | 0.000000 |
| 2.608529 | -0.000278 | -0.003013 | -0.028920 | 0.472830 | -0.545134 | 0.268717 | 0.250068 | 0.548755 | 6.883500 | 0.000000 |
| 1.201385 | -0.000045 | -0.000352 | -0.003339 | 0.063175 | 0.307654 | -0.163301 | -1.287100 | 3.522220 | -2.188420 | 0.000000 |
| 0.612431 | -0.000004 | -0.000104 | -0.000989 | 0.039810 | 0.687944 | -0.507419 | -0.783218 | -3.198740 | -3.319170 | 0.000000 |
| 0.295351 | -0.000007 | -0.000051 | -0.000511 | 0.016605 | 0.240715 | -0.293185 | 1.360040 | -0.159631 | 4.057580 | 0.000000 |
| 0.074368 | 0.000000 | -0.000005 | -0.000044 | 0.002902 | 0.115634 | 0.516140 | 1.063800 | 2.225970 | -2.458760 | 0.000000 |
| 0.037089 | -0.000001 | -0.000006 | -0.000057 | 0.002592 | 0.101533 | 0.503803 | -1.103800 | -1.355270 | 0.840359 | 0.000000 |
| 0.018050 | 0.000000 | -0.000001 | -0.000012 | 0.000785 | 0.032774 | 0.154766 | -0.241471 | -0.305572 | 0.467112 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys 145, 054111 (2016)