MOLPRO Basis Query, element=Fr, basis=augccpwCVQZ-DK3, l=p
Basis Fr p augccpwCVQZ-DK3
| Primitives | Contractions... |
|---|
| 72214733.000000 | 0.000016 | -0.000008 | -0.000004 | -0.000002 | -0.000001 | -0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 25507917.000000 | 0.000011 | -0.000006 | -0.000003 | -0.000001 | -0.000000 | -0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 9264384.400000 | 0.000044 | -0.000023 | -0.000012 | -0.000005 | -0.000002 | -0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 3536905.800000 | 0.000066 | -0.000035 | -0.000018 | -0.000008 | -0.000003 | -0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1406332.500000 | 0.000150 | -0.000079 | -0.000040 | -0.000018 | -0.000006 | -0.000001 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 579331.860000 | 0.000275 | -0.000144 | -0.000074 | -0.000034 | -0.000012 | -0.000002 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 246076.550000 | 0.000569 | -0.000299 | -0.000154 | -0.000070 | -0.000025 | -0.000004 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 107624.060000 | 0.001132 | -0.000598 | -0.000307 | -0.000139 | -0.000049 | -0.000008 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 48474.695000 | 0.002370 | -0.001256 | -0.000645 | -0.000293 | -0.000103 | -0.000017 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 22489.491000 | 0.005009 | -0.002669 | -0.001374 | -0.000624 | -0.000220 | -0.000037 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 10749.409000 | 0.010885 | -0.005842 | -0.003011 | -0.001367 | -0.000483 | -0.000080 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 5297.106600 | 0.023747 | -0.012891 | -0.006666 | -0.003031 | -0.001070 | -0.000178 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 2691.544400 | 0.051117 | -0.028224 | -0.014646 | -0.006661 | -0.002353 | -0.000391 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1409.023600 | 0.103763 | -0.058793 | -0.030737 | -0.014012 | -0.004952 | -0.000823 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 758.236270 | 0.187165 | -0.109782 | -0.057846 | -0.026405 | -0.009333 | -0.001552 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 418.117170 | 0.276017 | -0.168335 | -0.089852 | -0.041188 | -0.014573 | -0.002423 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 235.483760 | 0.293370 | -0.170034 | -0.088499 | -0.040200 | -0.014191 | -0.002360 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 134.426220 | 0.189758 | -0.009837 | 0.016482 | 0.010103 | 0.003739 | 0.000626 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 77.303622 | 0.057507 | 0.300864 | 0.247365 | 0.125795 | 0.045416 | 0.007560 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 45.328559 | 0.005177 | 0.464790 | 0.405179 | 0.208353 | 0.075252 | 0.012544 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 26.514615 | 0.000446 | 0.281577 | 0.123957 | 0.040986 | 0.013310 | 0.002181 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 15.325745 | -0.000292 | 0.063746 | -0.402024 | -0.293042 | -0.113116 | -0.018916 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 8.964465 | 0.000077 | 0.004031 | -0.556074 | -0.473016 | -0.189701 | -0.031917 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 5.208322 | -0.000079 | 0.000534 | -0.244991 | -0.090135 | -0.020231 | -0.003095 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 2.961104 | 0.000053 | -0.000225 | -0.034394 | 0.487244 | 0.254642 | 0.043484 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.661220 | -0.000025 | 0.000009 | -0.001588 | 0.552161 | 0.337615 | 0.059244 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.909793 | 0.000018 | -0.000040 | -0.000152 | 0.195029 | 0.052519 | 0.007396 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.498375 | -0.000011 | 0.000018 | 0.000076 | 0.020094 | -0.349870 | -0.066867 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.262863 | 0.000006 | -0.000010 | 0.000002 | 0.003028 | -0.491628 | -0.101119 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.138318 | -0.000004 | 0.000006 | 0.000007 | -0.000686 | -0.295561 | -0.103366 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.069625 | 0.000003 | -0.000004 | -0.000005 | 0.000494 | -0.064252 | -0.055940 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.038927 | -0.000002 | 0.000003 | 0.000003 | -0.000384 | -0.000971 | 0.188652 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.020296 | 0.000001 | -0.000002 | -0.000002 | 0.000215 | -0.002835 | 0.461254 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.011523 | -0.000001 | 0.000001 | 0.000001 | -0.000112 | 0.000892 | 0.381879 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.006444 | 0.000000 | -0.000000 | -0.000000 | 0.000029 | -0.000230 | 0.105188 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.145100 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.525440 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
| 0.241100 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 0.003600 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Phys. 147, 244106 (2017)