MOLPRO Basis Query, element=La, basis=cc-pwCVTZ-DK3, l=s
Basis La s cc-pwCVTZ-DK3
| Primitives | Contractions... |
|---|
| 72833810.000000 | 0.000194 | -0.000101 | 0.000055 | -0.000013 | 0.000007 | -0.000002 | 0.000005 | -0.000006 | -0.000009 | 0.000000 | 0.000000 | 0.000000 |
| 19054910.000000 | 0.000210 | -0.000110 | 0.000059 | -0.000014 | 0.000008 | -0.000002 | 0.000005 | -0.000007 | -0.000010 | 0.000000 | 0.000000 | 0.000000 |
| 6318252.000000 | 0.000589 | -0.000307 | 0.000166 | -0.000039 | 0.000022 | -0.000006 | 0.000015 | -0.000019 | -0.000027 | 0.000000 | 0.000000 | 0.000000 |
| 2296724.000000 | 0.000951 | -0.000497 | 0.000269 | -0.000063 | 0.000036 | -0.000010 | 0.000024 | -0.000030 | -0.000044 | 0.000000 | 0.000000 | 0.000000 |
| 896381.000000 | 0.001929 | -0.001009 | 0.000547 | -0.000129 | 0.000073 | -0.000020 | 0.000049 | -0.000061 | -0.000090 | 0.000000 | 0.000000 | 0.000000 |
| 366522.100000 | 0.003405 | -0.001785 | 0.000969 | -0.000229 | 0.000130 | -0.000036 | 0.000087 | -0.000109 | -0.000161 | 0.000000 | 0.000000 | 0.000000 |
| 156180.200000 | 0.006350 | -0.003341 | 0.001818 | -0.000429 | 0.000243 | -0.000067 | 0.000164 | -0.000204 | -0.000297 | 0.000000 | 0.000000 | 0.000000 |
| 68930.500000 | 0.011421 | -0.006042 | 0.003300 | -0.000780 | 0.000442 | -0.000122 | 0.000297 | -0.000371 | -0.000553 | 0.000000 | 0.000000 | 0.000000 |
| 31421.460000 | 0.020953 | -0.011180 | 0.006143 | -0.001455 | 0.000824 | -0.000227 | 0.000557 | -0.000691 | -0.000995 | 0.000000 | 0.000000 | 0.000000 |
| 14749.930000 | 0.038096 | -0.020597 | 0.011418 | -0.002713 | 0.001537 | -0.000424 | 0.001030 | -0.001288 | -0.001949 | 0.000000 | 0.000000 | 0.000000 |
| 7113.299000 | 0.069093 | -0.038196 | 0.021493 | -0.005129 | 0.002904 | -0.000801 | 0.001968 | -0.002436 | -0.003442 | 0.000000 | 0.000000 | 0.000000 |
| 3515.918000 | 0.120420 | -0.069073 | 0.039800 | -0.009575 | 0.005422 | -0.001494 | 0.003620 | -0.004544 | -0.007035 | 0.000000 | 0.000000 | 0.000000 |
| 1777.218000 | 0.191328 | -0.117350 | 0.070458 | -0.017176 | 0.009709 | -0.002680 | 0.006619 | -0.008154 | -0.011168 | 0.000000 | 0.000000 | 0.000000 |
| 916.882400 | 0.248747 | -0.171463 | 0.109904 | -0.027414 | 0.015495 | -0.004267 | 0.010266 | -0.012987 | -0.021098 | 0.000000 | 0.000000 | 0.000000 |
| 481.658700 | 0.223214 | -0.184108 | 0.129232 | -0.033303 | 0.018744 | -0.005184 | 0.013059 | -0.015827 | -0.019062 | 0.000000 | 0.000000 | 0.000000 |
| 256.541600 | 0.113554 | -0.071532 | 0.044837 | -0.011372 | 0.006483 | -0.001763 | 0.003470 | -0.005232 | -0.016530 | 0.000000 | 0.000000 | 0.000000 |
| 135.070300 | 0.060723 | 0.192872 | -0.246936 | 0.079533 | -0.044567 | 0.012282 | -0.028408 | 0.037493 | 0.075787 | 0.000000 | 0.000000 | 0.000000 |
| 73.389200 | 0.075583 | 0.360671 | -0.601251 | 0.222549 | -0.123737 | 0.034448 | -0.088991 | 0.107362 | 0.123293 | 0.000000 | 0.000000 | 0.000000 |
| 39.953970 | 0.047516 | 0.220968 | -0.470746 | 0.198125 | -0.111880 | 0.031039 | -0.068787 | 0.094198 | 0.214355 | 0.000000 | 0.000000 | 0.000000 |
| 20.937060 | 0.024816 | 0.145258 | 0.306116 | -0.217862 | 0.124939 | -0.034919 | 0.071386 | -0.107233 | -0.344225 | 0.000000 | 0.000000 | 0.000000 |
| 11.906630 | 0.030131 | 0.193550 | 0.751696 | -0.774706 | 0.468965 | -0.136632 | 0.393139 | -0.479281 | -0.512348 | 0.000000 | 0.000000 | 0.000000 |
| 6.604858 | 0.012896 | 0.082924 | 0.313459 | -0.312402 | 0.183037 | -0.051492 | 0.049743 | -0.102132 | -0.428868 | 0.000000 | 0.000000 | 0.000000 |
| 3.461124 | 0.000606 | 0.003166 | -0.009857 | 0.706192 | -0.541681 | 0.167657 | -0.389352 | 0.635884 | 2.012140 | 0.000000 | 0.000000 | 0.000000 |
| 1.857658 | -0.000249 | -0.002185 | -0.032469 | 0.642326 | -0.797866 | 0.288532 | -1.039670 | 1.390400 | 1.333880 | 0.000000 | 0.000000 | 0.000000 |
| 0.885059 | -0.000074 | -0.000594 | -0.005026 | 0.103607 | 0.057589 | -0.057920 | 1.187380 | -2.396880 | -8.736380 | 0.000000 | 0.000000 | 0.000000 |
| 0.480763 | 0.000005 | 0.000019 | -0.001186 | 0.051225 | 0.816621 | -0.373256 | 1.009700 | -1.033050 | 10.281100 | 0.000000 | 0.000000 | 0.000000 |
| 0.237869 | -0.000013 | -0.000108 | -0.000969 | 0.035987 | 0.466279 | -0.455422 | -0.897466 | 3.243100 | -4.231890 | 0.000000 | 0.000000 | 0.000000 |
| 0.074441 | 0.000002 | 0.000013 | -0.000017 | 0.001259 | 0.028837 | 0.376135 | -1.297990 | -1.543490 | -1.592480 | 0.000000 | 0.000000 | 0.000000 |
| 0.037380 | -0.000002 | -0.000012 | -0.000018 | 0.000210 | 0.000328 | 0.721700 | 0.411523 | -1.114570 | 3.565640 | 0.000000 | 0.000000 | 0.000000 |
| 0.017805 | 0.000000 | 0.000003 | 0.000000 | 0.000105 | 0.004460 | 0.171833 | 0.913263 | 1.577880 | -1.852610 | 1.000000 | 0.000000 | 0.000000 |
| 7.694355 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 4.806927 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)