MOLPRO Basis Query, element=Lu, basis=cc-pwCVQZ-X2C, l=d
Basis Lu d cc-pwCVQZ-X2C
Primitives | Contractions... |
45946.450000 | 0.000016 | -0.000008 | 0.000001 | 0.000003 | -0.000004 | 0.000005 | 0.000007 | 0.000000 | 0.000000 | 0.000000 |
11184.290000 | 0.000114 | -0.000055 | 0.000010 | 0.000025 | -0.000037 | 0.000038 | 0.000024 | 0.000000 | 0.000000 | 0.000000 |
3783.601000 | 0.000633 | -0.000310 | 0.000057 | 0.000138 | -0.000179 | 0.000209 | 0.000293 | 0.000000 | 0.000000 | 0.000000 |
1528.016000 | 0.002967 | -0.001452 | 0.000266 | 0.000649 | -0.000973 | 0.000995 | 0.000658 | 0.000000 | 0.000000 | 0.000000 |
691.594300 | 0.011773 | -0.005807 | 0.001066 | 0.002592 | -0.003382 | 0.003918 | 0.005329 | 0.000000 | 0.000000 | 0.000000 |
338.284400 | 0.038623 | -0.019198 | 0.003520 | 0.008602 | -0.012834 | 0.013216 | 0.009182 | 0.000000 | 0.000000 | 0.000000 |
174.492300 | 0.102950 | -0.052112 | 0.009605 | 0.023316 | -0.030402 | 0.035389 | 0.048493 | 0.000000 | 0.000000 | 0.000000 |
93.621930 | 0.212271 | -0.108240 | 0.019908 | 0.048819 | -0.074236 | 0.074898 | 0.044402 | 0.000000 | 0.000000 | 0.000000 |
51.426580 | 0.319930 | -0.159090 | 0.029293 | 0.071558 | -0.087781 | 0.107786 | 0.176081 | 0.000000 | 0.000000 | 0.000000 |
28.746660 | 0.317268 | -0.123938 | 0.021410 | 0.054023 | -0.110563 | 0.118006 | 0.026700 | 0.000000 | 0.000000 | 0.000000 |
16.096190 | 0.170956 | 0.092854 | -0.023330 | -0.062944 | 0.166384 | -0.183114 | -0.018866 | 1.000000 | 0.000000 | 0.000000 |
8.864934 | 0.040509 | 0.355593 | -0.077870 | -0.199326 | 0.294555 | -0.623996 | -1.433390 | 0.000000 | 1.000000 | 0.000000 |
4.785112 | 0.003345 | 0.417743 | -0.088205 | -0.252558 | 0.473509 | 0.023327 | 1.982350 | 0.000000 | 0.000000 | 0.000000 |
2.510494 | 0.000534 | 0.238182 | -0.022320 | 0.015036 | -0.978679 | 1.685210 | -0.237352 | 0.000000 | 0.000000 | 0.000000 |
1.245502 | 0.000068 | 0.055714 | 0.133291 | 0.742403 | -0.433265 | -1.648260 | -1.611740 | 0.000000 | 0.000000 | 0.000000 |
0.555241 | 0.000035 | 0.003476 | 0.307131 | 0.317000 | 1.056570 | 0.114934 | 2.116930 | 0.000000 | 0.000000 | 0.000000 |
0.234687 | -0.000005 | 0.000309 | 0.396369 | -0.351902 | 0.020189 | 1.018480 | -1.484930 | 0.000000 | 0.000000 | 0.000000 |
0.095727 | 0.000003 | -0.000048 | 0.329145 | -0.337565 | -0.449479 | -0.637424 | 0.202207 | 0.000000 | 0.000000 | 0.000000 |
0.037486 | -0.000001 | 0.000027 | 0.125027 | -0.124003 | -0.139902 | -0.243704 | 0.518184 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)