(2s2s) 1 S Z=22 Ti 20+
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 | 20.8912 | 2s | 22.8388 | 0.6238130371784267E+00 |
2 | 1s | 22.0000 | 2s | 22.8388 | -0.1739436263900862E-01 |
3 | 2s | 20.8912 | 1s | 22.0000 | 0.1336309979469251E-01 |
4 | 1s | 22.0000 | 1s | 22.0000 | -0.5269583403842793E-03 |
5 | 2s | 28.1308 | 3s | 44.9162 | 0.1777284176706439E-02 |
6 | 1s | 22.0000 | 3s | 44.9162 | 0.2804549755375595E-03 |
7 | 2s | 28.1308 | 1s | 22.0000 | 0.1981550343831296E-03 |
8 | 1s | 22.0000 | 1s | 22.0000 | 0.4422077843027545E-04 |
9 | 3s | 44.5281 | 4s | 47.8932 | -0.1373063853869345E-02 |
10 | 1s | 22.0000 | 4s | 47.8932 | -0.1539574271032628E-03 |
11 | 3s | 44.5281 | 1s | 22.0000 | -0.7950801333014294E-04 |
12 | 1s | 22.0000 | 1s | 22.0000 | -0.1260769836545021E-04 |
13 | 2p | 22.1987 | 2p | 20.7179 | 0.3401351336276255E+00 |
14 | 2p | 19.7067 | 4p | 36.4390 | -0.9982448402869890E-03 |
15 | 2p | 37.2529 | 4p | 72.2287 | 0.2280222200006075E-02 |
16 | 3d | 69.9159 | 3d | 69.9159 | 0.1503982044180648E-02 |
17 | 3d | 56.4218 | 4d | 126.4963 | -0.4122230957177106E-03 |
18 | 4f | 120.0569 | 4f | 120.0569 | -0.4184573695961072E-03 |
19 | 2p | 57.6431 | 2p | 57.6431 | -0.3070792603409953E-03 |
20 | 2p | 117.1172 | 3p | 124.4379 | 0.1273668515604653E-03 |
21 | 4p | 175.5411 | 4p | 175.5411 | -0.5430072361622636E-05 |
22 | 2p | 68.0725 | 4p | 155.5628 | -0.2208315042656274E-04 |
23 | 3p | 305.7345 | 4p | 297.6737 | 0.1265817833411766E-04 |
24 | 3d | 151.5734 | 3d | 151.5734 | -0.3752371157938226E-04 |
25 | 4d | 232.3905 | 4d | 232.3905 | -0.1000442852830013E-04 |
26 | 5d | 320.3485 | 5d | 320.3485 | 0.4634081030905676E-05 |
27 | 3d | 76.0011 | 5d | 211.2457 | 0.1242803544242566E-04 |
28 | 4f | 252.1324 | 4f | 252.1324 | 0.1674864930063356E-04 |
29 | 5f | 329.7377 | 5f | 329.7377 | -0.1009465816053664E-04 |
30 | 5g | 367.5444 | 5g | 367.5444 | 0.2083641577731781E-04 |
31 | 1s | 19.7459 | 1s | 23.6422 | 0.2497087539870672E-03 |
32 | 1s | 25.3299 | 4s | 164.5458 | 0.1046403893971238E-05 |
33 | 1s | 50.9174 | 2s | 100.6585 | -0.6317631475872802E-06 |
34 | 2s | 166.2939 | 4s | 171.9614 | 0.7162066458761467E-06 |
35 | 1s | 29.4276 | 3s | 62.3701 | -0.1558228197975359E-05 |
36 | 1s | 40.8127 | 2s | 99.1648 | 0.1136174830641156E-05 |
37 | 2s | 71.4212 | 3s | 90.0005 | -0.1218609727405863E-05 |
38 | 3s | 155.7436 | 4s | 154.1664 | -0.1142518658079828E-05 |
39 | 4s | 183.7563 | 5s | 212.9687 | -0.3873861347296049E-06 |
40 | 1s | 22.0048 | 2s | 21.0717 | 0.1204936293730937E-02 |
41 | 1s | 14.2015 | 2s | 47.6789 | 0.1196648826621451E-04 |
42 | 1s | 21.9940 | 3s | 21.1491 | 0.5583783904692787E-03 |
43 | 1s | 21.9960 | 4s | 21.1299 | 0.5682661226007654E-04 |
44 | 1s | 21.9960 | 5s | 21.1082 | 0.2474972869945853E-04 |
Energy= -118.32347596 a.u.