MOLPRO Basis Query, element=Zn, basis=aug-cc-pwCV5Z, l=s
Basis Zn s aug-cc-pwCV5Z
Primitives | Contractions... |
187413000.000000 | 0.000000 | -0.000000 | 0.000000 | -0.000000 | 0.000000 | -0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
33512700.000000 | 0.000001 | -0.000000 | 0.000000 | -0.000000 | 0.000000 | -0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
7504750.000000 | 0.000004 | -0.000001 | 0.000000 | -0.000000 | 0.000000 | -0.000000 | 0.000000 | 0.000001 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2017870.000000 | 0.000018 | -0.000005 | 0.000002 | -0.000000 | 0.000001 | -0.000002 | 0.000002 | 0.000002 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
628578.000000 | 0.000067 | -0.000021 | 0.000008 | -0.000002 | 0.000005 | -0.000006 | 0.000008 | 0.000009 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
220163.000000 | 0.000227 | -0.000070 | 0.000026 | -0.000005 | 0.000015 | -0.000021 | 0.000028 | 0.000025 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
84595.200000 | 0.000686 | -0.000212 | 0.000080 | -0.000016 | 0.000046 | -0.000064 | 0.000081 | 0.000095 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
34955.500000 | 0.001920 | -0.000594 | 0.000225 | -0.000045 | 0.000125 | -0.000175 | 0.000237 | 0.000206 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
15290.300000 | 0.005035 | -0.001565 | 0.000591 | -0.000118 | 0.000343 | -0.000474 | 0.000593 | 0.000732 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
6994.930000 | 0.012492 | -0.003913 | 0.001481 | -0.000297 | 0.000820 | -0.001152 | 0.001575 | 0.001279 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3316.590000 | 0.029312 | -0.009329 | 0.003534 | -0.000708 | 0.002067 | -0.002847 | 0.003517 | 0.004584 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1619.240000 | 0.064274 | -0.021099 | 0.008032 | -0.001610 | 0.004420 | -0.006230 | 0.008652 | 0.006488 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
810.343000 | 0.128029 | -0.044609 | 0.017085 | -0.003430 | 0.010114 | -0.013898 | 0.016896 | 0.023696 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
414.393000 | 0.219614 | -0.085439 | 0.033236 | -0.006678 | 0.018094 | -0.025725 | 0.036868 | 0.023608 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
216.058000 | 0.294328 | -0.139852 | 0.055732 | -0.011248 | 0.034167 | -0.046750 | 0.054450 | 0.091870 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
114.635000 | 0.259264 | -0.167491 | 0.070045 | -0.014191 | 0.035933 | -0.053041 | 0.086907 | 0.015846 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
61.762300 | 0.115413 | -0.078649 | 0.034609 | -0.007120 | 0.030741 | -0.038467 | 0.017404 | 0.183221 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
33.692400 | 0.017482 | 0.187147 | -0.094175 | 0.019642 | -0.077526 | 0.097003 | -0.052126 | -0.362086 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
18.531500 | 0.001234 | 0.477374 | -0.318578 | 0.068660 | -0.167919 | 0.275013 | -0.551173 | -0.256203 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
10.214400 | 0.000010 | 0.397461 | -0.374014 | 0.084517 | -0.356250 | 0.614914 | -1.154350 | -2.678416 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
5.594280 | 0.000054 | 0.111912 | -0.007223 | -0.002559 | 0.177698 | -0.464824 | 2.146837 | 8.318698 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3.009680 | -0.000090 | 0.010210 | 0.469905 | -0.124687 | 0.474913 | -1.468817 | 2.463242 | -7.754997 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.566840 | 0.000012 | 0.001535 | 0.565002 | -0.198173 | 0.852191 | -0.061234 | -6.092793 | 0.579892 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.781437 | -0.000013 | 0.000351 | 0.212845 | -0.162698 | -0.772487 | 2.533326 | 3.260483 | 4.480679 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.258118 | 0.000005 | 0.000009 | 0.010208 | 0.121268 | -1.431914 | -1.483831 | 2.078412 | -7.985668 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.138556 | -0.000004 | 0.000008 | -0.003217 | 0.414762 | 0.499195 | -0.944024 | -4.042447 | 7.933133 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.066171 | 0.000002 | -0.000004 | 0.000981 | 0.484087 | 0.549959 | 0.993434 | 1.742668 | -2.683339 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.030986 | -0.000000 | 0.000001 | -0.000213 | 0.141922 | 0.241389 | 0.283413 | 0.156902 | -0.042356 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
10.450800 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
3.919800 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.014510 | 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: basis set from gbasis database