MOLPRO Basis Query, element=Lu, basis=cc-pwCVDZ-DK3, l=s
Basis Lu s cc-pwCVDZ-DK3
Primitives | Contractions... |
59082970.000000 | 0.000580 | -0.000217 | 0.000102 | -0.000050 | -0.000019 | 0.000005 | 0.000025 | 0.000000 | 0.000000 |
14147040.000000 | 0.000777 | -0.000291 | 0.000137 | -0.000067 | -0.000026 | 0.000007 | 0.000033 | 0.000000 | 0.000000 |
4187217.000000 | 0.002040 | -0.000765 | 0.000361 | -0.000176 | -0.000068 | 0.000018 | 0.000087 | 0.000000 | 0.000000 |
1353230.000000 | 0.003799 | -0.001429 | 0.000675 | -0.000329 | -0.000128 | 0.000033 | 0.000162 | 0.000000 | 0.000000 |
470920.500000 | 0.007776 | -0.002939 | 0.001389 | -0.000676 | -0.000263 | 0.000068 | 0.000332 | 0.000000 | 0.000000 |
173558.600000 | 0.014775 | -0.005634 | 0.002668 | -0.001299 | -0.000504 | 0.000131 | 0.000644 | 0.000000 | 0.000000 |
67336.900000 | 0.028447 | -0.010992 | 0.005212 | -0.002541 | -0.000987 | 0.000257 | 0.001242 | 0.000000 | 0.000000 |
27333.180000 | 0.053590 | -0.021215 | 0.010110 | -0.004926 | -0.001913 | 0.000498 | 0.002466 | 0.000000 | 0.000000 |
11556.690000 | 0.100012 | -0.041073 | 0.019656 | -0.009617 | -0.003736 | 0.000971 | 0.004640 | 0.000000 | 0.000000 |
5068.433000 | 0.176908 | -0.077829 | 0.037783 | -0.018457 | -0.007178 | 0.001869 | 0.009424 | 0.000000 | 0.000000 |
2297.352000 | 0.275060 | -0.135421 | 0.066779 | -0.032995 | -0.012834 | 0.003335 | 0.015489 | 0.000000 | 0.000000 |
1072.715000 | 0.313827 | -0.187803 | 0.096732 | -0.047670 | -0.018611 | 0.004853 | 0.025837 | 0.000000 | 0.000000 |
512.910700 | 0.195491 | -0.108803 | 0.054597 | -0.027969 | -0.010854 | 0.002805 | 0.008692 | 0.000000 | 0.000000 |
236.748000 | 0.036952 | 0.271976 | -0.202429 | 0.112601 | 0.044676 | -0.011616 | -0.044186 | 0.000000 | 0.000000 |
118.536400 | -0.002195 | 0.571744 | -0.575498 | 0.329651 | 0.133677 | -0.035066 | -0.206157 | 0.000000 | 0.000000 |
60.580390 | 0.001397 | 0.299043 | -0.284815 | 0.193983 | 0.079960 | -0.020817 | -0.040287 | 0.000000 | 0.000000 |
29.336160 | -0.000801 | 0.029878 | 0.725556 | -0.746406 | -0.340528 | 0.090292 | 0.345614 | 0.000000 | 0.000000 |
15.269730 | 0.000400 | -0.001377 | 0.615320 | -0.758157 | -0.371943 | 0.100461 | 0.780019 | 0.000000 | 0.000000 |
6.731855 | -0.000172 | 0.000302 | 0.067135 | 0.775235 | 0.543735 | -0.153671 | -1.679230 | 1.000000 | 0.000000 |
3.273538 | 0.000077 | -0.000218 | -0.004459 | 0.750266 | 0.698949 | -0.209031 | 0.036390 | 0.000000 | 0.000000 |
0.999323 | -0.000025 | 0.000062 | 0.001356 | 0.044101 | -0.730055 | 0.272617 | 2.666500 | 0.000000 | 0.000000 |
0.441882 | 0.000011 | -0.000024 | -0.000608 | -0.008774 | -0.629213 | 0.410707 | -2.227030 | 0.000000 | 0.000000 |
0.079462 | -0.000003 | 0.000008 | 0.000124 | 0.002229 | -0.022515 | -0.663258 | -0.288393 | 0.000000 | 0.000000 |
0.031583 | 0.000001 | -0.000002 | -0.000084 | -0.000423 | 0.005225 | -0.522217 | 0.704119 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)