MOLPRO Basis Query, element=Y, basis=aug-cc-pwCVTZ-DK, l=s
Basis Y s aug-cc-pwCVTZ-DK
| Primitives | Contractions... |
|---|
| 125652000.000000 | 0.000038 | -0.000022 | 0.000006 | -0.000002 | 0.000001 | 0.000001 | 0.000001 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 20133700.000000 | 0.000099 | -0.000057 | 0.000015 | -0.000005 | 0.000001 | 0.000002 | 0.000004 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 4277710.000000 | 0.000275 | -0.000159 | 0.000042 | -0.000015 | 0.000004 | 0.000007 | 0.000010 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1129920.000000 | 0.000634 | -0.000368 | 0.000097 | -0.000035 | 0.000010 | 0.000016 | 0.000023 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 351974.000000 | 0.001381 | -0.000803 | 0.000212 | -0.000076 | 0.000021 | 0.000035 | 0.000051 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 123945.000000 | 0.002869 | -0.001672 | 0.000442 | -0.000159 | 0.000043 | 0.000072 | 0.000104 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 47739.900000 | 0.005923 | -0.003465 | 0.000920 | -0.000330 | 0.000090 | 0.000152 | 0.000225 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 19619.200000 | 0.012332 | -0.007257 | 0.001934 | -0.000695 | 0.000190 | 0.000313 | 0.000442 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 8450.360000 | 0.026160 | -0.015563 | 0.004192 | -0.001505 | 0.000410 | 0.000701 | 0.001056 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 3769.020000 | 0.055682 | -0.033749 | 0.009211 | -0.003311 | 0.000905 | 0.001476 | 0.002035 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1727.910000 | 0.113863 | -0.071665 | 0.020194 | -0.007238 | 0.001974 | 0.003412 | 0.005240 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 811.040000 | 0.205102 | -0.139030 | 0.041226 | -0.014808 | 0.004053 | 0.006511 | 0.008709 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 389.111000 | 0.281437 | -0.222609 | 0.073175 | -0.026190 | 0.007142 | 0.012671 | 0.020296 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 190.717000 | 0.228734 | -0.233890 | 0.087430 | -0.031629 | 0.008700 | 0.012848 | 0.014059 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 95.443300 | 0.089028 | -0.040165 | 0.009999 | -0.003401 | 0.000831 | 0.005548 | 0.019175 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 48.682100 | 0.082440 | 0.355316 | -0.250444 | 0.094624 | -0.025890 | -0.053048 | -0.103015 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 25.203200 | 0.108343 | 0.513836 | -0.494637 | 0.204461 | -0.057376 | -0.077072 | -0.062750 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 13.141900 | 0.044295 | 0.212977 | -0.214240 | 0.085602 | -0.023022 | -0.078136 | -0.215710 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 6.816690 | 0.010844 | 0.036049 | 0.493947 | -0.253865 | 0.071290 | 0.196026 | 0.496500 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 3.453390 | 0.008461 | 0.020081 | 0.690777 | -0.612789 | 0.193892 | 0.219961 | 0.028899 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.665910 | 0.001932 | 0.004334 | 0.158159 | -0.126494 | 0.031243 | 0.271433 | 0.953796 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.790042 | -0.000054 | -0.000154 | 0.001526 | 0.743677 | -0.285239 | -1.043973 | -3.346746 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.358279 | 0.000020 | 0.000027 | 0.003405 | 0.559772 | -0.394798 | -0.222266 | 2.761267 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.095482 | -0.000012 | -0.000027 | -0.000431 | 0.047575 | 0.150120 | 2.668641 | 1.372407 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.053917 | 0.000009 | 0.000019 | 0.000364 | -0.019050 | 0.675762 | -1.342086 | -3.942212 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.023809 | -0.000002 | -0.000005 | -0.000089 | 0.005000 | 0.363927 | -0.791758 | 2.260843 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.850200 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
| 0.404000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 0.010500 | 0.000000 | 0.000000 | 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)