(2p2p) 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 | 2p | 2.1176 | 2p | 3.0848 | 0.7265046616378484E+00 |
| 2 | 2p | 3.3206 | 4p | 4.8367 | -0.1941946960557969E-01 |
| 3 | 3p | 7.1878 | 3p | 7.1878 | -0.1468992425831729E-01 |
| 4 | 4p | 9.1683 | 3p | 5.3784 | 0.1245228990047272E-01 |
| 5 | 4p | 6.9422 | 2p | 3.4560 | 0.1366555268540793E-01 |
| 6 | 2s | 3.1547 | 3d | 4.3491 | 0.1712075455186012E+00 |
| 7 | 1s | 3.0000 | 3d | 4.3491 | 0.4968447483414524E-02 |
| 8 | 3s | 4.6040 | 4d | 7.7029 | 0.1562796844957141E-01 |
| 9 | 1s | 3.0000 | 4d | 7.7029 | 0.1513942690489637E-02 |
| 10 | 2s | 2.7186 | 5d | 6.3071 | 0.4553923254199343E-02 |
| 11 | 1s | 3.0000 | 5d | 6.3071 | -0.2337693745375948E-03 |
| 12 | 3s | 9.5374 | 5d | 13.2549 | 0.1940678161952010E-02 |
| 13 | 1s | 3.0000 | 5d | 13.2549 | -0.5944730013113314E-04 |
| 14 | 4s | 6.9452 | 4d | 10.6867 | 0.4321529906839674E-02 |
| 15 | 1s | 3.0000 | 4d | 10.6867 | 0.2293867440053087E-03 |
| 16 | 3s | 1.9785 | 3d | 7.3084 | -0.4154763211670310E-03 |
| 17 | 1s | 3.0000 | 3d | 7.3084 | 0.3369601985149864E-04 |
| 18 | 3d | 5.2984 | 3d | 5.2984 | 0.4667065946361539E-01 |
| 19 | 4d | 7.7716 | 4d | 7.7716 | 0.9662511999783383E-02 |
| 20 | 4d | 12.1647 | 5d | 11.5308 | 0.2419260523254035E-02 |
| 21 | 2p | 3.1529 | 4f | 8.8087 | 0.2990293187301384E-01 |
| 22 | 3p | 4.7455 | 5f | 12.4953 | 0.5477845148749377E-02 |
| 23 | 3d | 5.8356 | 5g | 14.1801 | -0.7693684366744815E-02 |
| 24 | 2p | 3.3777 | 2p | 3.3777 | 0.8305804525827017E-02 |
| 25 | 2p | 4.9077 | 4f | 6.6377 | -0.1845280381504290E-02 |
| 26 | 1s | 3.0000 | 3d | 2.0014 | 0.4809527080335708E-02 |
| 27 | 1s | 3.0000 | 4d | 2.0014 | 0.3564870527327622E-02 |
| 28 | 1s | 3.0000 | 5d | 2.0014 | 0.2671514801396634E-02 |
Energy= -1.77091558 a.u.