MOLPRO Basis Query, element=Ru, basis=AVTZ-DK, l=s
Basis Ru s AVTZ-DK
Primitives | Contractions... |
192708000.000000 | 0.000043 | -0.000022 | 0.000007 | -0.000003 | 0.000001 | 0.000001 | 0.000002 | 0.000000 | 0.000000 |
30168800.000000 | 0.000114 | -0.000057 | 0.000018 | -0.000007 | 0.000002 | 0.000004 | 0.000005 | 0.000000 | 0.000000 |
6339070.000000 | 0.000313 | -0.000156 | 0.000048 | -0.000019 | 0.000005 | 0.000010 | 0.000015 | 0.000000 | 0.000000 |
1668940.000000 | 0.000710 | -0.000355 | 0.000110 | -0.000044 | 0.000012 | 0.000024 | 0.000034 | 0.000000 | 0.000000 |
520455.000000 | 0.001513 | -0.000758 | 0.000234 | -0.000094 | 0.000025 | 0.000051 | 0.000072 | 0.000000 | 0.000000 |
183800.000000 | 0.003063 | -0.001539 | 0.000476 | -0.000191 | 0.000050 | 0.000102 | 0.000147 | 0.000000 | 0.000000 |
70986.500000 | 0.006141 | -0.003099 | 0.000962 | -0.000385 | 0.000101 | 0.000209 | 0.000299 | 0.000000 | 0.000000 |
29211.000000 | 0.012376 | -0.006285 | 0.001958 | -0.000783 | 0.000207 | 0.000413 | 0.000599 | 0.000000 | 0.000000 |
12572.000000 | 0.025427 | -0.013061 | 0.004106 | -0.001640 | 0.000432 | 0.000903 | 0.001283 | 0.000000 | 0.000000 |
5590.350000 | 0.052784 | -0.027633 | 0.008780 | -0.003508 | 0.000925 | 0.001822 | 0.002664 | 0.000000 | 0.000000 |
2549.930000 | 0.107188 | -0.058225 | 0.018983 | -0.007565 | 0.001994 | 0.004232 | 0.005965 | 0.000000 | 0.000000 |
1189.060000 | 0.197168 | -0.114926 | 0.038978 | -0.015534 | 0.004099 | 0.007916 | 0.011705 | 0.000000 | 0.000000 |
566.384000 | 0.287537 | -0.193506 | 0.071221 | -0.028256 | 0.007455 | 0.016324 | 0.022695 | 0.000000 | 0.000000 |
275.714000 | 0.263366 | -0.226024 | 0.092547 | -0.036927 | 0.009768 | 0.017137 | 0.026780 | 0.000000 | 0.000000 |
137.242000 | 0.112664 | -0.075190 | 0.030635 | -0.012177 | 0.003211 | 0.013387 | 0.014322 | 0.000000 | 0.000000 |
69.809600 | 0.055188 | 0.307219 | -0.220738 | 0.091845 | -0.024499 | -0.066185 | -0.084570 | 0.000000 | 0.000000 |
36.175100 | 0.073522 | 0.528313 | -0.505941 | 0.230223 | -0.062145 | -0.094292 | -0.169262 | 0.000000 | 0.000000 |
18.968600 | 0.034576 | 0.258727 | -0.298611 | 0.139639 | -0.038023 | -0.147667 | -0.154661 | 0.000000 | 0.000000 |
9.947490 | 0.011321 | 0.047955 | 0.449294 | -0.264193 | 0.074258 | 0.289681 | 0.340941 | 0.000000 | 0.000000 |
5.124900 | 0.010233 | 0.025136 | 0.739589 | -0.739632 | 0.227188 | 0.275729 | 0.676768 | 0.000000 | 0.000000 |
2.529080 | 0.002589 | 0.005737 | 0.182602 | -0.104090 | 0.023251 | 0.445183 | 0.255538 | 0.000000 | 0.000000 |
1.228240 | -0.000055 | -0.000166 | 0.003449 | 0.818566 | -0.331370 | -1.760763 | -3.511998 | 0.000000 | 0.000000 |
0.557666 | 0.000019 | -0.000040 | 0.002933 | 0.521075 | -0.333168 | 0.555424 | 3.790650 | 0.000000 | 0.000000 |
0.141219 | -0.000011 | -0.000017 | -0.000238 | 0.034706 | 0.276189 | 2.053787 | -1.545526 | 0.000000 | 0.000000 |
0.067797 | 0.000007 | 0.000009 | 0.000202 | -0.011930 | 0.621772 | -1.363043 | -0.655439 | 0.000000 | 0.000000 |
0.029950 | -0.000002 | -0.000003 | -0.000060 | 0.004127 | 0.289343 | -0.427453 | 1.216472 | 1.000000 | 0.000000 |
0.013200 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: K. A. Peterson, D. Figgen, M. Dolg, and H. Stoll, J. Chem. Phys. 126, 124101 (2007)