MOLPRO Basis Query, element=La, basis=cc-pwCVQZ-DK3, l=f
Basis La f cc-pwCVQZ-DK3
Primitives | Contractions... |
332.860600 | 0.000291 | -0.000352 | 0.000203 | -0.000580 | 0.000324 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
114.959100 | 0.002584 | -0.002939 | 0.000654 | -0.000123 | 0.001020 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
49.093360 | 0.013104 | -0.015636 | 0.007786 | -0.019952 | 0.010718 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
23.131980 | 0.042245 | -0.047900 | 0.010190 | -0.000763 | 0.004548 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
11.440730 | 0.104102 | -0.125627 | 0.067796 | -0.174962 | 0.096941 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
5.869989 | 0.188971 | -0.217703 | 0.041350 | 0.003082 | 0.162796 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
3.020409 | 0.260361 | -0.327561 | 0.292818 | -0.818808 | 0.799136 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.536163 | 0.289726 | -0.289195 | -0.113269 | 1.280490 | -2.510600 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.761590 | 0.260913 | 0.506134 | -0.944437 | -0.012494 | 2.875260 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.362775 | 0.192038 | 0.433049 | 0.495839 | -1.199520 | -1.887210 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.164754 | 0.103670 | 0.067791 | 0.563636 | 0.888921 | 0.442004 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.072108 | 0.026193 | -0.000354 | 0.128169 | 0.184563 | 0.428812 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.023803 | 0.000530 | -0.001404 | 0.001195 | 0.019416 | -0.006463 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
3.977496 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
2.165114 | 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)
|