(1s5d) 1 D Z= 3 Li 1+
Table 1. Novikov N.V. // Wave Function Value Database http://cdfe.sinp.msu.ru/services/wftables/
j | R n1,l1 (α1,r) | R n2,l2 (α2,r) | g | ||
n1 l1 | α1 | n2 l2 | α2 | ||
1 | 1s | 3.0000 | 5d | 2.0014 | 0.9999929817650810E+00 |
2 | 2p | 3.3777 | 2p | 3.3777 | -0.3039754072833912E-02 |
3 | 2p | 4.9077 | 4f | 6.6377 | 0.2189802151778801E-02 |
4 | 1s | 3.0000 | 3d | 2.0014 | -0.2682703382259402E-04 |
5 | 1s | 3.0000 | 4d | 2.0014 | -0.1904219612014882E-04 |
Energy= -4.58002867 a.u.