MOLPRO Basis Query, element=Au, basis=AVTZ-DK, l=d
Basis Au d AVTZ-DK
Primitives | Contractions... |
60300.100000 | 0.000019 | -0.000010 | 0.000003 | -0.000003 | 0.000004 | 0.000000 | 0.000000 |
16134.100000 | 0.000113 | -0.000060 | 0.000018 | -0.000020 | 0.000026 | 0.000000 | 0.000000 |
5376.510000 | 0.000617 | -0.000327 | 0.000096 | -0.000111 | 0.000143 | 0.000000 | 0.000000 |
2119.530000 | 0.002812 | -0.001490 | 0.000440 | -0.000504 | 0.000641 | 0.000000 | 0.000000 |
947.077000 | 0.010957 | -0.005852 | 0.001730 | -0.001998 | 0.002567 | 0.000000 | 0.000000 |
463.167000 | 0.035047 | -0.018853 | 0.005585 | -0.006402 | 0.008154 | 0.000000 | 0.000000 |
241.045000 | 0.092764 | -0.050805 | 0.015088 | -0.017471 | 0.022532 | 0.000000 | 0.000000 |
130.581000 | 0.194524 | -0.107474 | 0.032000 | -0.036727 | 0.046993 | 0.000000 | 0.000000 |
72.398200 | 0.306982 | -0.166661 | 0.049411 | -0.057154 | 0.073030 | 0.000000 | 0.000000 |
40.563400 | 0.327247 | -0.145872 | 0.040979 | -0.044943 | 0.053024 | 0.000000 | 0.000000 |
22.753800 | 0.190228 | 0.069014 | -0.034436 | 0.042847 | -0.064886 | 0.000000 | 0.000000 |
12.691700 | 0.052604 | 0.347551 | -0.129575 | 0.161835 | -0.228975 | 0.000000 | 0.000000 |
7.002660 | 0.008139 | 0.429821 | -0.159720 | 0.168902 | -0.173054 | 0.000000 | 0.000000 |
3.804750 | 0.002478 | 0.240948 | -0.021591 | 0.017144 | -0.003744 | 0.000000 | 0.000000 |
1.984240 | 0.000426 | 0.052351 | 0.239297 | -0.443532 | 1.062381 | 0.000000 | 0.000000 |
0.992375 | 0.000039 | 0.003175 | 0.393505 | -0.491996 | -0.363530 | 0.000000 | 0.000000 |
0.474078 | -0.000014 | 0.000778 | 0.351467 | 0.292793 | -1.020045 | 0.000000 | 0.000000 |
0.215360 | 0.000000 | 0.000118 | 0.196654 | 0.573924 | 0.537821 | 0.000000 | 0.000000 |
0.091127 | -0.000002 | 0.000077 | 0.048712 | 0.211863 | 0.484681 | 1.000000 | 0.000000 |
0.038600 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set from gbasis database