MOLPRO Basis Query, element=Es, basis=cc-pVQZ-DK3, l=d
Basis Es d cc-pVQZ-DK3
| Primitives | Contractions... |
|---|
| 652262.780000 | 0.000003 | -0.000001 | 0.000001 | 0.000000 | -0.000000 | 0.000000 | -0.000001 | -0.000001 | 0.000000 |
| 150364.110000 | 0.000016 | -0.000007 | 0.000004 | 0.000001 | -0.000002 | 0.000003 | -0.000003 | -0.000002 | 0.000000 |
| 46933.820000 | 0.000072 | -0.000030 | 0.000018 | 0.000004 | -0.000009 | 0.000011 | -0.000013 | -0.000017 | 0.000000 |
| 17337.091000 | 0.000289 | -0.000118 | 0.000072 | 0.000017 | -0.000036 | 0.000047 | -0.000046 | -0.000036 | 0.000000 |
| 7196.160300 | 0.001079 | -0.000443 | 0.000270 | 0.000066 | -0.000133 | 0.000167 | -0.000195 | -0.000273 | 0.000000 |
| 3264.467600 | 0.003781 | -0.001556 | 0.000949 | 0.000230 | -0.000471 | 0.000622 | -0.000598 | -0.000460 | 0.000000 |
| 1588.430300 | 0.012266 | -0.005097 | 0.003108 | 0.000756 | -0.001536 | 0.001923 | -0.002240 | -0.003122 | 0.000000 |
| 816.604200 | 0.035659 | -0.014957 | 0.009114 | 0.002213 | -0.004527 | 0.005980 | -0.005764 | -0.004484 | 0.000000 |
| 438.171120 | 0.090133 | -0.038577 | 0.023499 | 0.005718 | -0.011617 | 0.014513 | -0.016996 | -0.023899 | 0.000000 |
| 243.286980 | 0.187824 | -0.081302 | 0.049463 | 0.012019 | -0.024623 | 0.032788 | -0.030924 | -0.021591 | 0.000000 |
| 138.213010 | 0.302305 | -0.128875 | 0.078568 | 0.019129 | -0.038847 | 0.047750 | -0.059863 | -0.094858 | 0.000000 |
| 79.994974 | 0.338946 | -0.120512 | 0.072951 | 0.017528 | -0.036315 | 0.052669 | -0.038670 | 0.013136 | 0.000000 |
| 46.662953 | 0.215377 | 0.043298 | -0.029773 | -0.008056 | 0.017922 | -0.035326 | 0.004130 | -0.108330 | 0.000000 |
| 27.188067 | 0.035696 | 0.306921 | -0.192282 | -0.049138 | 0.099448 | -0.114306 | 0.204466 | 0.471078 | 0.000000 |
| 15.925606 | -0.050163 | 0.436567 | -0.278552 | -0.070316 | 0.152102 | -0.243551 | 0.134359 | -0.266794 | 0.000000 |
| 9.331702 | -0.037441 | 0.275935 | -0.061713 | -0.009538 | 0.005126 | 0.069876 | 0.158709 | 0.972768 | 0.000000 |
| 5.404489 | -0.010124 | 0.072642 | 0.326773 | 0.104293 | -0.205627 | 0.224879 | -0.883147 | -2.982440 | 0.000000 |
| 3.059475 | -0.000433 | 0.004307 | 0.476037 | 0.149785 | -0.409195 | 1.017740 | -0.522011 | 2.937020 | 0.000000 |
| 1.676385 | 0.000158 | -0.000901 | 0.292106 | 0.055444 | -0.021155 | -1.373790 | 2.652760 | -0.175996 | 0.000000 |
| 0.873265 | 0.000083 | -0.000363 | 0.078018 | -0.149525 | 0.827293 | -0.445469 | -2.318790 | -2.182490 | 0.000000 |
| 0.409587 | -0.000005 | -0.000009 | 0.006707 | -0.347502 | 0.282963 | 1.218450 | 0.301709 | 2.688450 | 0.000000 |
| 0.182171 | 0.000004 | -0.000007 | 0.000373 | -0.402216 | -0.441620 | -0.064155 | 1.081090 | -1.882640 | 0.000000 |
| 0.078756 | -0.000002 | 0.000003 | 0.000015 | -0.283256 | -0.358886 | -0.493428 | -0.742611 | 0.402811 | 0.000000 |
| 0.032772 | 0.000000 | -0.000001 | 0.000010 | -0.082231 | -0.097828 | -0.114453 | -0.219001 | 0.473364 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)
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