(2s2p) 1 P Z= 5 B 3+
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 | 4.2661 | 2p | 4.8758 | 0.7630972045232678E+00 |
| 2 | 1s | 5.0000 | 2p | 4.8758 | -0.6027847052900022E-01 |
| 3 | 2s | 6.6177 | 2p | 4.4485 | 0.2438825846058225E+00 |
| 4 | 1s | 5.0000 | 2p | 4.4485 | 0.4456313264149941E-01 |
| 5 | 3s | 8.1047 | 2p | 6.4287 | -0.3539232053216927E-01 |
| 6 | 1s | 5.0000 | 2p | 6.4287 | -0.3701977059069307E-02 |
| 7 | 2s | 4.7305 | 4p | 10.1902 | 0.3191085369059103E-01 |
| 8 | 1s | 5.0000 | 4p | 10.1902 | -0.9508407620735690E-03 |
| 9 | 4s | 13.4065 | 4p | 13.1416 | -0.1024618749791171E-01 |
| 10 | 1s | 5.0000 | 4p | 13.1416 | -0.3785225577096520E-03 |
| 11 | 3s | 15.0328 | 2p | 15.9979 | 0.2852674426402093E-02 |
| 12 | 1s | 5.0000 | 2p | 15.9979 | -0.3122317312312605E-05 |
| 13 | 5s | 17.6550 | 5p | 17.2750 | -0.3004894011408757E-02 |
| 14 | 1s | 5.0000 | 5p | 17.2750 | -0.2175447821835961E-04 |
| 15 | 2p | 3.7858 | 3d | 7.1851 | -0.1359926137971350E+00 |
| 16 | 4p | 10.7444 | 3d | 8.2489 | 0.2907444033857190E-01 |
| 17 | 3p | 10.5586 | 5d | 16.1489 | -0.8558018153033331E-02 |
| 18 | 2p | 13.2034 | 4d | 17.3758 | 0.9729515749093004E-02 |
| 19 | 5p | 24.7637 | 5d | 23.5336 | 0.2639673154757837E-02 |
| 20 | 4f | 14.0546 | 5g | 21.1246 | -0.7508234592927910E-02 |
| 21 | 2p | 9.9361 | 3d | 15.0683 | -0.7864527717715749E-02 |
| 22 | 2p | 6.6253 | 5d | 24.5537 | 0.5999276237920844E-03 |
| 23 | 3p | 16.5437 | 4d | 26.8500 | -0.8507978717651339E-04 |
| 24 | 3d | 18.8164 | 4f | 28.7360 | 0.2458693297500308E-02 |
| 25 | 4d | 26.7768 | 5f | 38.8266 | 0.2876971323751608E-02 |
| 26 | 1s | 5.0500 | 2p | 3.9698 | -0.4899035176775139E-03 |
| 27 | 1s | 3.8191 | 3p | 7.4132 | 0.4628473886002301E-05 |
| 28 | 2s | 10.8974 | 2p | 4.5924 | 0.4136893197551598E-05 |
| 29 | 2s | 8.8317 | 3p | 17.1909 | 0.1019942336471435E-05 |
| 30 | 1s | 4.9414 | 3p | 24.2251 | -0.4695204502516090E-06 |
| 31 | 1s | 4.9981 | 3p | 3.9671 | 0.1058834081702563E-03 |
| 32 | 1s | 5.0000 | 4p | 3.9695 | -0.3248532163582920E-04 |
| 33 | 1s | 5.0000 | 5p | 3.9752 | -0.2432088672175232E-04 |
Energy= -5.37622613 a.u.