RETURN

(2s2p) 1 P       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 21.2817 2p 21.9294 0.9648265321601193E+00
2 1s 22.0000 2p 21.9294 -0.1749434776311625E-01
3 2s 35.3222 2p 18.7558 0.4016980965091650E-01
4 1s 22.0000 2p 18.7558 0.1325156999527451E-01
5 3s 58.1222 2p 32.3525 -0.1062747853123447E-01
6 1s 22.0000 2p 32.3525 -0.5853320016172912E-03
7 2s 17.9214 4p 48.9352 0.9751778179435488E-02
8 1s 22.0000 4p 48.9352 -0.9584925874799741E-03
9 4s 57.3988 4p 56.0375 -0.5068624623347466E-02
10 1s 22.0000 4p 56.0375 -0.2042767107177688E-03
11 3s 62.0976 2p 46.5858 0.6620324027232693E-02
12 1s 22.0000 2p 46.5858 0.1891314759030275E-03
13 5s 74.6988 5p 73.2568 -0.9164751798507248E-03
14 1s 22.0000 5p 73.2568 -0.8632980899374129E-05
15 2p 16.5232 3d 33.3929 -0.3152534744062069E-01
16 4p 48.4256 3d 37.9513 0.8450490929615582E-02
17 3p 49.7536 5d 75.4761 -0.2392376427562402E-02
18 2p 61.3518 4d 86.5429 0.2701070160151099E-02
19 5p 113.1613 5d 106.6221 0.6849142191811716E-03
20 4f 64.7362 5g 96.5170 -0.2170502807264276E-02
21 2p 45.5502 3d 72.6324 -0.2278417044994130E-02
22 2p 25.9912 5d 124.2496 -0.5596749674425677E-03
23 3p 76.1306 4d 127.3494 -0.3959095596775230E-03
24 3d 86.4319 4f 134.3972 0.7046858799321032E-03
25 4d 123.6988 5f 180.9396 0.8177801011339735E-03
26 1s 22.0483 2p 20.9533 -0.3793893093765900E-03
27 1s 20.2022 3p 38.3651 0.7749259976778368E-06
28 2s 45.8624 2p 21.6020 0.8985238333900107E-06
29 2s 39.8022 3p 74.1554 0.4172617822574161E-06
30 1s 21.4862 3p 101.5898 -0.1939927450315408E-06
31 1s 21.9978 3p 20.9634 -0.1044788434691000E-03
32 1s 22.0000 4p 20.9635 -0.6353528081854165E-04
33 1s 22.0000 5p 20.9704 -0.4217332877780358E-04

Energy= -116.87622072 a.u.

RETURN