MOLPRO Basis Query, element=Lu, basis=cc-pwCVQZ-DK3, l=d
Basis Lu d cc-pwCVQZ-DK3
Primitives | Contractions... |
45946.450000 | 0.000017 | -0.000008 | 0.000002 | 0.000004 | -0.000005 | 0.000006 | 0.000007 | 0.000000 | 0.000000 | 0.000000 |
11184.290000 | 0.000119 | -0.000058 | 0.000011 | 0.000026 | -0.000039 | 0.000040 | 0.000026 | 0.000000 | 0.000000 | 0.000000 |
3783.601000 | 0.000645 | -0.000315 | 0.000058 | 0.000141 | -0.000182 | 0.000213 | 0.000297 | 0.000000 | 0.000000 | 0.000000 |
1528.016000 | 0.002981 | -0.001459 | 0.000267 | 0.000652 | -0.000977 | 0.001000 | 0.000664 | 0.000000 | 0.000000 | 0.000000 |
691.594300 | 0.011782 | -0.005812 | 0.001067 | 0.002594 | -0.003385 | 0.003921 | 0.005331 | 0.000000 | 0.000000 | 0.000000 |
338.284400 | 0.038625 | -0.019198 | 0.003520 | 0.008602 | -0.012834 | 0.013216 | 0.009185 | 0.000000 | 0.000000 | 0.000000 |
174.492300 | 0.102946 | -0.052110 | 0.009604 | 0.023314 | -0.030402 | 0.035387 | 0.048489 | 0.000000 | 0.000000 | 0.000000 |
93.621930 | 0.212264 | -0.108237 | 0.019907 | 0.048816 | -0.074234 | 0.074895 | 0.044408 | 0.000000 | 0.000000 | 0.000000 |
51.426580 | 0.319927 | -0.159089 | 0.029292 | 0.071556 | -0.087785 | 0.107779 | 0.176075 | 0.000000 | 0.000000 | 0.000000 |
28.746660 | 0.317271 | -0.123942 | 0.021410 | 0.054022 | -0.110560 | 0.118004 | 0.026701 | 0.000000 | 0.000000 | 0.000000 |
16.096190 | 0.170960 | 0.092847 | -0.023328 | -0.062936 | 0.166372 | -0.183104 | -0.018861 | 1.000000 | 0.000000 | 0.000000 |
8.864934 | 0.040511 | 0.355588 | -0.077867 | -0.199320 | 0.294564 | -0.623919 | -1.433290 | 0.000000 | 1.000000 | 0.000000 |
4.785112 | 0.003345 | 0.417746 | -0.088203 | -0.252548 | 0.473495 | 0.023189 | 1.982010 | 0.000000 | 0.000000 | 0.000000 |
2.510494 | 0.000534 | 0.238188 | -0.022323 | 0.015004 | -0.978597 | 1.685210 | -0.236849 | 0.000000 | 0.000000 | 0.000000 |
1.245502 | 0.000068 | 0.055716 | 0.133285 | 0.742377 | -0.433362 | -1.648080 | -1.612090 | 0.000000 | 0.000000 | 0.000000 |
0.555241 | 0.000035 | 0.003476 | 0.307124 | 0.317051 | 1.056560 | 0.114713 | 2.116980 | 0.000000 | 0.000000 | 0.000000 |
0.234687 | -0.000005 | 0.000309 | 0.396361 | -0.351886 | 0.020240 | 1.018570 | -1.484740 | 0.000000 | 0.000000 | 0.000000 |
0.095727 | 0.000003 | -0.000048 | 0.329152 | -0.337571 | -0.449453 | -0.637338 | 0.201970 | 0.000000 | 0.000000 | 0.000000 |
0.037486 | -0.000001 | 0.000027 | 0.125050 | -0.124025 | -0.139938 | -0.243800 | 0.518276 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
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