MOLPRO Basis Query, element=Au, basis=ECP60MDF_AV5Z, l=d
Basis Au d ECP60MDF_AV5Z
Primitives | Contractions... |
62.030900 | 0.000086 | -0.000159 | 0.000597 | 0.000522 | 0.006645 | 0.000000 | 0.000000 |
21.098800 | -0.000796 | 0.001475 | -0.006535 | -0.006381 | -0.072830 | 0.000000 | 0.000000 |
13.120000 | 0.009136 | -0.012851 | 0.029495 | 0.038985 | 0.133493 | 0.000000 | 0.000000 |
6.312570 | -0.066301 | 0.090969 | -0.158100 | -0.260786 | 0.113624 | 0.000000 | 0.000000 |
2.141450 | 0.165563 | -0.274077 | 0.691427 | 2.035288 | -3.889724 | 0.000000 | 0.000000 |
1.299370 | 0.241441 | -0.444884 | 0.591997 | -1.399120 | 7.904899 | 0.000000 | 0.000000 |
0.810358 | 0.271022 | -0.202324 | -0.776642 | -1.415319 | -5.674397 | 0.000000 | 0.000000 |
0.472707 | 0.268013 | 0.220378 | -0.738404 | 1.166861 | 0.485667 | 0.000000 | 0.000000 |
0.255648 | 0.186875 | 0.485503 | 0.183170 | 0.770311 | 1.229852 | 0.000000 | 0.000000 |
0.130895 | 0.081314 | 0.301647 | 0.587885 | -0.653150 | -0.071889 | 0.000000 | 0.000000 |
0.062779 | 0.013419 | 0.066884 | 0.184543 | -0.342561 | -0.653156 | 1.000000 | 0.000000 |
0.030100 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set of Peterson and Puzzarini, Ref 39, for PP of Ref 37.