MOLPRO Basis Query, element=Mn, basis=AWCVQZ, l=p
Basis Mn p AWCVQZ
Primitives | Contractions... |
35005.120000 | 0.000011 | -0.000004 | -0.000001 | 0.000001 | 0.000003 | -0.000003 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
8279.462000 | 0.000098 | -0.000034 | -0.000008 | 0.000010 | 0.000021 | -0.000032 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2688.465000 | 0.000572 | -0.000199 | -0.000046 | 0.000061 | 0.000138 | -0.000165 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1029.490000 | 0.002604 | -0.000907 | -0.000208 | 0.000278 | 0.000568 | -0.000852 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
438.070800 | 0.009779 | -0.003425 | -0.000792 | 0.001052 | 0.002368 | -0.002864 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
200.615300 | 0.030938 | -0.010985 | -0.002522 | 0.003366 | 0.006887 | -0.010338 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
97.007690 | 0.082194 | -0.029856 | -0.006928 | 0.009193 | 0.020805 | -0.024920 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
48.870520 | 0.176149 | -0.066366 | -0.015292 | 0.020404 | 0.041207 | -0.063908 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
25.292810 | 0.289133 | -0.113504 | -0.026611 | 0.035277 | 0.082949 | -0.091704 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
13.353820 | 0.330956 | -0.137991 | -0.031978 | 0.042986 | 0.082330 | -0.168833 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
7.131786 | 0.212218 | -0.049355 | -0.011222 | 0.014783 | 0.067649 | -0.045717 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3.764365 | 0.055227 | 0.191242 | 0.054988 | -0.070851 | -0.250587 | 0.447543 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.946265 | 0.001207 | 0.402355 | 0.110465 | -0.148863 | -0.378784 | 1.044544 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.985455 | -0.002355 | 0.382116 | 0.128162 | -0.172661 | -0.396517 | -1.485721 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.481865 | -0.001320 | 0.168199 | -0.002980 | -0.004857 | 1.150112 | -0.530604 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.189212 | -0.000094 | 0.017905 | -0.336824 | 0.571881 | 0.383085 | 1.821718 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.077980 | -0.000007 | -0.000958 | -0.542441 | 0.501328 | -0.892328 | -1.068450 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.031685 | 0.000000 | 0.000486 | -0.248633 | 0.032271 | -0.053087 | -0.128101 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
7.333200 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
1.931700 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.012870 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 123, 064107 (2005)