(1s2s) 1 S Z=21 Sc 19+
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 | 21.0150 | 2s | 20.0612 | 0.9916869101959390E+00 |
2 | 1s | 13.3224 | 2s | 46.1576 | 0.1178100806629171E-01 |
3 | 1s | 31.6480 | 4s | 144.7584 | 0.7911172630255150E-03 |
4 | 2s | 147.6612 | 4s | 152.1850 | 0.7366854012381282E-03 |
5 | 1s | 29.2049 | 3s | 58.4614 | -0.2366322621626018E-02 |
6 | 2s | 71.7151 | 3s | 127.1561 | -0.9559888910180619E-03 |
7 | 3s | 146.7664 | 4s | 144.3053 | -0.1034378189328957E-02 |
8 | 4s | 169.8194 | 5s | 203.0439 | -0.1702590189471981E-03 |
9 | 2p | 55.0139 | 2p | 55.0139 | 0.1488914128936083E-02 |
10 | 2p | 112.2324 | 3p | 118.0714 | 0.4785292836260209E-03 |
11 | 4p | 167.4345 | 4p | 167.4345 | -0.8617488184063212E-04 |
12 | 2p | 64.5993 | 4p | 148.3671 | -0.1050043034578410E-02 |
13 | 3p | 292.1430 | 4p | 284.2661 | 0.9905008861381710E-04 |
14 | 3d | 144.6323 | 3d | 144.6323 | -0.3191179371899073E-03 |
15 | 4d | 221.7639 | 4d | 221.7639 | 0.1512198588998652E-03 |
16 | 5d | 305.7376 | 5d | 305.7376 | -0.7649482455989951E-05 |
17 | 3d | 72.5033 | 5d | 201.7747 | 0.5363332056292985E-03 |
18 | 4f | 240.5453 | 4f | 240.5453 | 0.1150527252435116E-03 |
19 | 5f | 314.5598 | 5f | 314.5598 | 0.8547294753578751E-05 |
20 | 5g | 350.8206 | 5g | 350.8206 | -0.5079225322072131E-04 |
21 | 1s | 18.8434 | 1s | 22.5669 | -0.7818574641273930E-02 |
22 | 1s | 50.6562 | 2s | 74.7060 | 0.2517581034490206E-04 |
23 | 1s | 40.1333 | 2s | 84.9598 | -0.3573088611062186E-04 |
Energy= -270.86584332 a.u.