(1s2s) 1 S 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 | 1s | 4.9966 | 2s | 4.1032 | 0.9801515412002187E+00 |
2 | 1s | 3.2618 | 2s | 11.7677 | 0.3061013263168283E-01 |
3 | 1s | 5.6207 | 4s | 37.4070 | 0.1545620208364682E-02 |
4 | 2s | 42.7474 | 4s | 42.0498 | 0.5609929522340333E-03 |
5 | 1s | 6.7749 | 3s | 13.3415 | -0.9201642986120400E-02 |
6 | 2s | 29.3060 | 3s | 19.9813 | -0.1715402629669770E-02 |
7 | 3s | 43.3140 | 4s | 36.4524 | -0.1494148084359152E-02 |
8 | 4s | 51.0528 | 5s | 52.4514 | -0.2226869456801501E-03 |
9 | 2p | 12.5444 | 2p | 12.5444 | 0.6262231150704766E-02 |
10 | 2p | 25.6429 | 3p | 27.1889 | 0.1812215620103575E-02 |
11 | 4p | 38.1440 | 4p | 38.1440 | -0.2721925301562288E-03 |
12 | 2p | 15.2215 | 4p | 34.0528 | -0.3708529738831422E-02 |
13 | 3p | 66.2450 | 4p | 64.5609 | 0.3579657097479637E-03 |
14 | 3d | 33.0847 | 3d | 33.0847 | -0.1237503664516265E-02 |
15 | 4d | 50.7882 | 4d | 50.7882 | 0.4406353552057133E-03 |
16 | 5d | 70.1528 | 5d | 70.1528 | -0.5893448112678282E-04 |
17 | 3d | 16.8624 | 5d | 46.2282 | 0.1802297212748410E-02 |
18 | 4f | 55.2180 | 4f | 55.2180 | 0.4493034232161927E-03 |
19 | 5f | 72.1285 | 5f | 72.1285 | 0.6310274637759740E-04 |
20 | 5g | 80.7251 | 5g | 80.7251 | -0.1969284938819398E-03 |
21 | 1s | 3.9343 | 1s | 5.3819 | -0.3520781350742258E-01 |
22 | 1s | 8.2850 | 2s | 10.9955 | 0.7235205675775340E-03 |
23 | 1s | 5.6057 | 2s | 14.9242 | -0.1079823640272651E-02 |
Energy= -14.57548548 a.u.