MOLPRO Basis Query, element=Au, basis=AWCVTZ-DK3, l=d
Basis Au d AWCVTZ-DK3
| Primitives | Contractions... |
|---|
| 60300.100000 | 0.000019 | -0.000010 | 0.000003 | -0.000003 | 0.000004 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 16134.100000 | 0.000113 | -0.000060 | 0.000018 | -0.000020 | 0.000026 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 5376.510000 | 0.000617 | -0.000326 | 0.000096 | -0.000111 | 0.000143 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 2119.530000 | 0.002811 | -0.001489 | 0.000440 | -0.000504 | 0.000641 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 947.077000 | 0.010956 | -0.005851 | 0.001729 | -0.001998 | 0.002568 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 463.167000 | 0.035042 | -0.018849 | 0.005583 | -0.006401 | 0.008155 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 241.045000 | 0.092754 | -0.050795 | 0.015083 | -0.017470 | 0.022538 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 130.581000 | 0.194509 | -0.107457 | 0.031991 | -0.036726 | 0.046998 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 72.398200 | 0.306974 | -0.166646 | 0.049401 | -0.057157 | 0.073062 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 40.563400 | 0.327257 | -0.145879 | 0.040977 | -0.044953 | 0.053029 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 22.753800 | 0.190252 | 0.068976 | -0.034412 | 0.042826 | -0.064834 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 12.691700 | 0.052609 | 0.347515 | -0.129544 | 0.161835 | -0.229108 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 7.002660 | 0.008130 | 0.429820 | -0.159691 | 0.168922 | -0.173031 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 3.804750 | 0.002472 | 0.240998 | -0.021634 | 0.017200 | -0.004050 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.984240 | 0.000425 | 0.052378 | 0.239192 | -0.443390 | 1.063236 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.992375 | 0.000039 | 0.003174 | 0.393429 | -0.492252 | -0.364331 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.474078 | -0.000014 | 0.000778 | 0.351471 | 0.292612 | -1.019703 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.215360 | 0.000000 | 0.000119 | 0.196805 | 0.573894 | 0.537828 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.091127 | -0.000002 | 0.000077 | 0.048833 | 0.211972 | 0.484398 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
| 5.002100 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
| 1.253700 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 0.038600 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set from gbasis database