MOLPRO Basis Query, element=Kr, basis=AV5Z-PP, l=s
Basis Kr s AV5Z-PP
Primitives | Contractions... |
196415.000000 | 0.000014 | -0.000006 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
29445.800000 | 0.000112 | -0.000050 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
6706.760000 | 0.000575 | -0.000251 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1900.010000 | 0.002232 | -0.000997 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
617.921000 | 0.006493 | -0.002820 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
216.890000 | 0.012048 | -0.005538 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
41.461600 | 0.144311 | -0.060047 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
25.912800 | -0.221801 | 0.105665 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
16.192400 | -0.260467 | 0.079832 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
10.115121 | 0.008032 | 0.009547 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4.457210 | 0.568334 | -0.298089 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2.298900 | 0.546896 | -0.439700 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.112030 | 0.102329 | -0.068587 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.584958 | -0.001515 | 0.539442 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.269540 | 0.002017 | 0.591923 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.120066 | -0.000071 | 0.151510 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.045200 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pV5Z (17s14p14d4f3g2h)/[8s7p6d4f3g2h] basis set for ECP10MDF by K.A. Peterson et al, Ref 36.