(2s2p) 3 P Z= 8 O 6+
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 | 2s | 8.5403 | 2p | 7.5744 | 0.9423264127197358E+00 |
| 2 | 1s | 8.0000 | 2p | 7.5744 | 0.3587785811929933E-01 |
| 3 | 3s | 11.8105 | 2p | 8.0525 | -0.1452679667945112E+00 |
| 4 | 1s | 8.0000 | 2p | 8.0525 | -0.1312249215305718E-01 |
| 5 | 2s | 6.6718 | 3p | 14.7970 | 0.1470996475910511E-01 |
| 6 | 1s | 8.0000 | 3p | 14.7970 | -0.1304955151717021E-02 |
| 7 | 4s | 31.7557 | 2p | 21.5072 | 0.9698924586589543E-03 |
| 8 | 1s | 8.0000 | 2p | 21.5072 | 0.2122421906905397E-07 |
| 9 | 2p | 7.6553 | 3d | 13.7660 | -0.3098006007984405E-01 |
| 10 | 3p | 14.8897 | 4d | 23.8904 | -0.2523603678236537E-02 |
| 11 | 4p | 19.8174 | 4d | 17.8146 | 0.1195886817671792E-02 |
| 12 | 3d | 13.6170 | 4f | 24.5093 | 0.4030232739870290E-02 |
| 13 | 2p | 12.2440 | 3d | 19.9493 | 0.5164727307823878E-02 |
| 14 | 3p | 21.7262 | 3d | 31.0530 | 0.2191466146351552E-02 |
| 15 | 3d | 33.5352 | 4f | 36.6204 | -0.4424164551188873E-03 |
| 16 | 4p | 33.8866 | 4d | 42.4702 | 0.9217261992167627E-03 |
| 17 | 1s | 8.0029 | 2p | 7.6756 | 0.6301436340791648E-02 |
| 18 | 1s | 7.9608 | 3p | 10.1763 | -0.7986775309085974E-03 |
| 19 | 2s | 12.2540 | 2p | 12.0031 | -0.1032856649418250E-03 |
| 20 | 2s | 14.1940 | 3p | 20.5519 | -0.3711011044140461E-04 |
| 21 | 1s | 7.7430 | 5p | 21.8226 | 0.6013681282900333E-04 |
| 22 | 3s | 24.7787 | 3p | 34.4656 | -0.1101065686951746E-04 |
| 23 | 1s | 7.9944 | 3p | 7.1694 | 0.3542458288545107E-02 |
| 24 | 1s | 7.9317 | 4p | 12.1973 | 0.2773863927889261E-03 |
| 25 | 2p | 13.1486 | 3d | 10.4093 | -0.1317667478363050E-04 |
| 26 | 1s | 8.0000 | 4p | 7.0623 | 0.1996913082825100E-02 |
| 27 | 1s | 8.2863 | 5p | 14.2736 | 0.6931839818217342E-05 |
| 28 | 1s | 8.0015 | 5p | 7.0898 | 0.1409188136318174E-02 |
Energy= -14.96478736 a.u.