MOLPRO Basis Query, element=Lu, basis=ROOS_DZP, l=s
Basis Lu s ROOS_DZP
Primitives | Contractions... |
50315163.600000 | 0.000673 | -0.000252 | 0.000119 | -0.000058 | 0.000022 | -0.000006 | 0.000009 |
10641810.100000 | 0.001103 | -0.000413 | 0.000195 | -0.000095 | 0.000037 | -0.000011 | 0.000014 |
2810703.630000 | 0.002839 | -0.001065 | 0.000503 | -0.000245 | 0.000095 | -0.000027 | 0.000037 |
827289.334000 | 0.005801 | -0.002187 | 0.001033 | -0.000503 | 0.000195 | -0.000056 | 0.000076 |
266370.537000 | 0.012295 | -0.004670 | 0.002210 | -0.001076 | 0.000418 | -0.000120 | 0.000163 |
92147.914200 | 0.024782 | -0.009534 | 0.004520 | -0.002202 | 0.000855 | -0.000245 | 0.000334 |
33896.723100 | 0.050074 | -0.019695 | 0.009371 | -0.004567 | 0.001777 | -0.000510 | 0.000695 |
13115.786000 | 0.099368 | -0.040575 | 0.019419 | -0.009487 | 0.003683 | -0.001057 | 0.001437 |
5285.355280 | 0.189290 | -0.082867 | 0.040143 | -0.019637 | 0.007659 | -0.002199 | 0.003002 |
2206.336270 | 0.308777 | -0.153549 | 0.076026 | -0.037479 | 0.014543 | -0.004173 | 0.005663 |
952.022679 | 0.340542 | -0.209473 | 0.108137 | -0.053592 | 0.021090 | -0.006064 | 0.008322 |
420.734274 | 0.160899 | -0.053920 | 0.022764 | -0.011209 | 0.003846 | -0.001081 | 0.001299 |
192.403959 | 0.010231 | 0.443474 | -0.353401 | 0.196685 | -0.077280 | 0.022202 | -0.029892 |
91.355231 | 0.003190 | 0.566569 | -0.638874 | 0.383115 | -0.160121 | 0.046422 | -0.064857 |
44.557841 | -0.002479 | 0.140241 | 0.131222 | -0.110434 | 0.057800 | -0.017273 | 0.026351 |
22.185716 | 0.001663 | 0.005643 | 0.918074 | -1.081772 | 0.494652 | -0.144891 | 0.200638 |
10.800101 | -0.001019 | -0.001439 | 0.290384 | -0.147133 | 0.085343 | -0.026431 | 0.039916 |
5.143400 | 0.000551 | 0.000801 | 0.003776 | 1.090849 | -0.878937 | 0.279077 | -0.461383 |
2.330207 | -0.000245 | -0.000474 | 0.002845 | 0.357038 | -0.302330 | 0.102845 | 0.010618 |
0.845567 | 0.000109 | 0.000226 | -0.000926 | -0.005103 | 0.991481 | -0.433048 | 0.641542 |
0.338227 | -0.000067 | -0.000136 | 0.000467 | 0.006174 | 0.386751 | -0.437705 | 0.394569 |
0.135291 | 0.000039 | 0.000082 | -0.000278 | -0.003425 | -0.017343 | 0.446272 | -1.653014 |
0.054116 | -0.000022 | -0.000046 | 0.000151 | 0.001911 | 0.014187 | 0.794604 | 0.122414 |
0.021647 | 0.000010 | 0.000022 | -0.000072 | -0.000890 | -0.004626 | 0.077642 | 1.066204 |
0.008659 | -0.000003 | -0.000006 | 0.000021 | 0.000257 | 0.001352 | 0.003108 | 0.046004 |
Comment: B. O. Roos, R. Lindh, P.-A. Malmqvist, V. Veryazov, P.-O. Widmark, J. Phys. Chem. A, 112, 11431-11435 (2008)