MOLPRO Basis Query, element=Pb, basis=aug-cc-pVQZ-DK3, l=s
Basis Pb s aug-cc-pVQZ-DK3
Primitives | Contractions... |
736775130.000000 | 0.000207 | -0.000082 | 0.000039 | -0.000020 | -0.000009 | -0.000003 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
213953830.000000 | 0.000179 | -0.000071 | 0.000034 | -0.000017 | -0.000008 | -0.000003 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
67836484.000000 | 0.000599 | -0.000236 | 0.000114 | -0.000057 | -0.000026 | -0.000009 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
23134017.000000 | 0.000944 | -0.000372 | 0.000179 | -0.000090 | -0.000041 | -0.000014 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
8379893.000000 | 0.001922 | -0.000759 | 0.000365 | -0.000184 | -0.000083 | -0.000028 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3191201.500000 | 0.003306 | -0.001307 | 0.000629 | -0.000318 | -0.000142 | -0.000048 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1267082.000000 | 0.005986 | -0.002374 | 0.001144 | -0.000577 | -0.000259 | -0.000087 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
521168.990000 | 0.010297 | -0.004105 | 0.001980 | -0.000999 | -0.000448 | -0.000150 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
220979.000000 | 0.017918 | -0.007204 | 0.003479 | -0.001757 | -0.000788 | -0.000265 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
96247.237000 | 0.030638 | -0.012481 | 0.006041 | -0.003051 | -0.001369 | -0.000460 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
42958.799000 | 0.052467 | -0.021814 | 0.010595 | -0.005357 | -0.002405 | -0.000808 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
19620.234000 | 0.088489 | -0.037984 | 0.018548 | -0.009385 | -0.004213 | -0.001415 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
9162.422900 | 0.145175 | -0.065567 | 0.032310 | -0.016402 | -0.007372 | -0.002477 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4373.661700 | 0.220135 | -0.107885 | 0.053937 | -0.027438 | -0.012330 | -0.004140 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2134.010300 | 0.279965 | -0.155528 | 0.079702 | -0.040898 | -0.018442 | -0.006201 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1064.313600 | 0.246431 | -0.152751 | 0.080025 | -0.041069 | -0.018465 | -0.006195 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
542.489980 | 0.109458 | 0.012845 | -0.019532 | 0.011482 | 0.005246 | 0.001750 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
282.433720 | 0.013887 | 0.361936 | -0.298869 | 0.173791 | 0.081025 | 0.027445 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
150.012870 | 0.000871 | 0.506635 | -0.543256 | 0.334217 | 0.157066 | 0.053107 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
81.123627 | -0.000504 | 0.228649 | -0.189694 | 0.127412 | 0.063919 | 0.022133 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
44.527917 | 0.000368 | 0.024204 | 0.647238 | -0.679588 | -0.372971 | -0.130556 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
24.699434 | -0.000329 | 0.000968 | 0.621338 | -0.853772 | -0.482985 | -0.168429 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
13.764583 | 0.000241 | -0.000306 | 0.124200 | 0.245207 | 0.184482 | 0.064305 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
7.648308 | -0.000156 | -0.000037 | 0.011495 | 0.922888 | 0.927899 | 0.374538 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4.197165 | 0.000097 | -0.000025 | -0.002318 | 0.375620 | 0.522248 | 0.214336 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2.248324 | -0.000052 | 0.000013 | 0.001457 | 0.016667 | -0.742583 | -0.405297 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.123589 | 0.000025 | 0.000003 | -0.000873 | 0.005069 | -0.763808 | -0.563967 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.513180 | -0.000014 | -0.000000 | 0.000463 | -0.001994 | -0.117323 | -0.092382 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.275940 | 0.000008 | 0.000000 | -0.000274 | 0.001238 | 0.005571 | 0.518626 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.128349 | -0.000003 | -0.000000 | 0.000097 | -0.000444 | -0.001806 | 0.614044 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.057535 | 0.000001 | 0.000000 | -0.000022 | 0.000101 | 0.000255 | 0.177170 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.021963 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: D.H. Bross and K.A. Peterson, Theor. Chem. Acc. 133, 1434(2013)