MOLPRO Basis Query, element=Au, basis=cc-pwCVQZ-PP, l=s
Basis Au s cc-pwCVQZ-PP
| Primitives | Contractions... |
|---|
| 1403.840000 | 0.000009 | -0.000003 | -0.000006 | -0.000016 | 0.000038 | 0.000000 | 0.000000 | 0.000000 |
| 98.865500 | 0.000740 | -0.000287 | -0.000654 | 0.001407 | -0.015850 | 0.000000 | 0.000000 | 0.000000 |
| 61.610300 | -0.005943 | 0.002148 | 0.004596 | -0.006325 | 0.086428 | 0.000000 | 0.000000 | 0.000000 |
| 38.467000 | 0.038444 | -0.013258 | -0.026911 | -0.000593 | -0.265571 | 0.000000 | 0.000000 | 0.000000 |
| 24.023000 | -0.184722 | 0.063900 | 0.128420 | 0.107411 | 0.641134 | 0.000000 | 0.000000 | 0.000000 |
| 14.925100 | 0.432654 | -0.153900 | -0.311522 | -0.345510 | -1.095147 | 0.000000 | 0.000000 | 0.000000 |
| 7.397950 | -0.338550 | 0.137055 | 0.272377 | 0.203807 | 1.158613 | 0.000000 | 0.000000 | 0.000000 |
| 4.621920 | -0.603872 | 0.215048 | 0.500643 | 1.111297 | 1.045789 | 0.000000 | 0.000000 | 0.000000 |
| 1.719610 | 0.621398 | -0.297498 | -0.848152 | -3.199130 | -8.330135 | 0.000000 | 0.000000 | 0.000000 |
| 0.955604 | 0.641389 | -0.371944 | -1.304741 | 0.813451 | 11.846977 | 0.000000 | 0.000000 | 0.000000 |
| 0.495584 | 0.174240 | -0.132663 | 1.462214 | 3.181468 | -5.977621 | 0.000000 | 0.000000 | 0.000000 |
| 0.203770 | 0.008493 | 0.360188 | 1.143878 | -2.454102 | -0.700339 | 0.000000 | 0.000000 | 0.000000 |
| 0.088332 | 0.001592 | 0.623471 | -0.758421 | -0.496033 | 3.103334 | 0.000000 | 0.000000 | 0.000000 |
| 0.038380 | 0.000713 | 0.254044 | -0.563408 | 1.226041 | -1.829348 | 1.000000 | 0.000000 | 0.000000 |
| 1.234000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 0.772300 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set of Peterson and Puzzarini, Ref 39, for PP of Ref 37.