MOLPRO Basis Query, element=Ac, basis=ROOS_DZP, l=p
Basis Ac p ROOS_DZP
Primitives | Contractions... |
23770799.300000 | 0.000042 | -0.000022 | 0.000011 | -0.000005 | 0.000002 | -0.000001 | 0.000002 |
4792928.260000 | 0.000098 | -0.000052 | 0.000027 | -0.000012 | 0.000005 | -0.000002 | 0.000004 |
1171896.040000 | 0.000277 | -0.000146 | 0.000076 | -0.000035 | 0.000014 | -0.000005 | 0.000012 |
324477.375000 | 0.000720 | -0.000381 | 0.000197 | -0.000092 | 0.000036 | -0.000012 | 0.000032 |
98972.693000 | 0.001930 | -0.001024 | 0.000530 | -0.000246 | 0.000097 | -0.000033 | 0.000087 |
32810.823000 | 0.005272 | -0.002814 | 0.001458 | -0.000680 | 0.000267 | -0.000090 | 0.000237 |
11767.737700 | 0.014709 | -0.007932 | 0.004120 | -0.001916 | 0.000755 | -0.000255 | 0.000677 |
4556.295110 | 0.040793 | -0.022339 | 0.011645 | -0.005442 | 0.002141 | -0.000724 | 0.001888 |
1893.147170 | 0.106459 | -0.059982 | 0.031504 | -0.014681 | 0.005790 | -0.001959 | 0.005216 |
835.147666 | 0.235758 | -0.138409 | 0.073447 | -0.034533 | 0.013588 | -0.004591 | 0.011902 |
386.447355 | 0.374216 | -0.230108 | 0.123771 | -0.057807 | 0.022867 | -0.007743 | 0.020937 |
185.532997 | 0.324494 | -0.141247 | 0.063993 | -0.029572 | 0.011357 | -0.003808 | 0.008541 |
90.071599 | 0.101581 | 0.313708 | -0.262577 | 0.139671 | -0.055798 | 0.018857 | -0.046203 |
45.477782 | 0.002701 | 0.586481 | -0.512295 | 0.264075 | -0.107760 | 0.036723 | -0.106044 |
22.889039 | 0.001506 | 0.233323 | 0.102945 | -0.098041 | 0.047085 | -0.016558 | 0.064003 |
11.442777 | -0.000975 | 0.014217 | 0.745107 | -0.637735 | 0.277869 | -0.094905 | 0.221632 |
5.690993 | 0.000476 | 0.001551 | 0.336135 | -0.110169 | 0.040798 | -0.014307 | 0.092513 |
2.646565 | -0.000230 | -0.000762 | 0.017117 | 0.803560 | -0.544646 | 0.199830 | -0.713685 |
1.233775 | 0.000113 | 0.000268 | 0.001461 | 0.403416 | -0.168454 | 0.055103 | 0.146199 |
0.465871 | -0.000047 | -0.000121 | -0.000686 | 0.020361 | 0.763290 | -0.373295 | 1.248547 |
0.186348 | 0.000026 | 0.000068 | 0.000363 | -0.000968 | 0.427391 | -0.234089 | -1.077779 |
0.074539 | -0.000014 | -0.000037 | -0.000197 | 0.000120 | 0.005309 | 0.568070 | -0.607117 |
0.029816 | 0.000007 | 0.000018 | 0.000096 | -0.000046 | 0.010005 | 0.581779 | 0.782405 |
0.011926 | -0.000002 | -0.000006 | -0.000030 | 0.000010 | -0.003332 | 0.063594 | 0.184473 |
Comment: B.O. Roos, R. Lindh, P.-A. Malmqvist, V. Veryazov, and P.-O. Widmark, Chem. Phys.Letters 409, 295 (2005)