MOLPRO Basis Query, element=Ac, basis=cc-pwCVDZ-DK3, l=s
Basis Ac s cc-pwCVDZ-DK3
Primitives | Contractions... |
56835935.000000 | 0.001751 | -0.000392 | -0.000669 | -0.000108 | 0.000113 | -0.000039 | 0.000012 | -0.000038 | 0.000000 | 0.000000 |
14800328.000000 | 0.001720 | -0.000385 | -0.000657 | -0.000107 | 0.000111 | -0.000039 | 0.000012 | -0.000038 | 0.000000 | 0.000000 |
4849164.200000 | 0.004728 | -0.001060 | -0.001809 | -0.000293 | 0.000306 | -0.000106 | 0.000033 | -0.000104 | 0.000000 | 0.000000 |
1727447.600000 | 0.007047 | -0.001586 | -0.002705 | -0.000439 | 0.000458 | -0.000159 | 0.000049 | -0.000155 | 0.000000 | 0.000000 |
657067.420000 | 0.013817 | -0.003130 | -0.005331 | -0.000867 | 0.000905 | -0.000314 | 0.000097 | -0.000306 | 0.000000 | 0.000000 |
260505.580000 | 0.022860 | -0.005238 | -0.008906 | -0.001452 | 0.001514 | -0.000525 | 0.000163 | -0.000512 | 0.000000 | 0.000000 |
107242.240000 | 0.040555 | -0.009456 | -0.016021 | -0.002622 | 0.002733 | -0.000947 | 0.000294 | -0.000926 | 0.000000 | 0.000000 |
45581.357000 | 0.067846 | -0.016278 | -0.027470 | -0.004523 | 0.004711 | -0.001633 | 0.000506 | -0.001591 | 0.000000 | 0.000000 |
19960.192000 | 0.114218 | -0.028618 | -0.047915 | -0.007976 | 0.008286 | -0.002870 | 0.000889 | -0.002812 | 0.000000 | 0.000000 |
8982.297100 | 0.180899 | -0.048608 | -0.080743 | -0.013641 | 0.014143 | -0.004900 | 0.001518 | -0.004759 | 0.000000 | 0.000000 |
4146.062400 | 0.260288 | -0.077683 | -0.127191 | -0.022085 | 0.022763 | -0.007873 | 0.002440 | -0.007760 | 0.000000 | 0.000000 |
1959.396800 | 0.290797 | -0.099457 | -0.162020 | -0.028949 | 0.029739 | -0.010298 | 0.003190 | -0.009882 | 0.000000 | 0.000000 |
945.216930 | 0.197394 | -0.052295 | -0.082669 | -0.013392 | 0.013909 | -0.004793 | 0.001487 | -0.005109 | 0.000000 | 0.000000 |
451.987200 | 0.046730 | 0.143216 | 0.274742 | 0.076878 | -0.074003 | 0.025389 | -0.007882 | 0.026030 | 0.000000 | 0.000000 |
228.593070 | 0.002711 | 0.269766 | 0.731703 | 0.234010 | -0.224133 | 0.077408 | -0.024036 | 0.073401 | 0.000000 | 0.000000 |
118.308990 | 0.003288 | 0.167089 | 0.467721 | 0.171135 | -0.163629 | 0.056633 | -0.017615 | 0.061277 | 0.000000 | 0.000000 |
58.128783 | -0.037028 | 0.296664 | -0.601713 | -0.546280 | 0.534078 | -0.192413 | 0.060204 | -0.205574 | 0.000000 | 0.000000 |
30.849797 | -0.036818 | 0.273916 | -0.687654 | -0.720462 | 0.751593 | -0.282945 | 0.088999 | -0.263850 | 0.000000 | 0.000000 |
14.462253 | -0.005467 | 0.046375 | -0.053451 | 0.472641 | -0.700325 | 0.311225 | -0.099877 | 0.300078 | 0.000000 | 0.000000 |
7.699900 | 0.001273 | -0.001289 | 0.070278 | 0.632192 | -1.316540 | 0.674670 | -0.221344 | 0.801535 | 0.000000 | 0.000000 |
3.131345 | -0.000195 | 0.002430 | 0.005396 | 0.244488 | 0.638526 | -0.603154 | 0.213910 | -1.064850 | 1.000000 | 0.000000 |
1.655086 | 0.000101 | -0.000470 | 0.002096 | 0.169125 | 0.826384 | -0.913941 | 0.352058 | -0.975194 | 0.000000 | 0.000000 |
0.557226 | -0.000042 | 0.000345 | -0.000058 | 0.020838 | 0.076516 | 0.738629 | -0.412807 | 3.774590 | 0.000000 | 0.000000 |
0.266437 | 0.000019 | -0.000141 | 0.000119 | -0.001052 | 0.006079 | 0.697637 | -0.503247 | -2.875610 | 0.000000 | 0.000000 |
0.059572 | -0.000005 | 0.000038 | -0.000024 | 0.001093 | 0.002898 | 0.031110 | 0.704461 | -0.329384 | 0.000000 | 0.000000 |
0.024753 | 0.000002 | -0.000016 | 0.000010 | -0.000424 | -0.001038 | -0.004198 | 0.540670 | 0.859173 | 0.000000 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)