(2s2s) 1 S Z=26 Fe 24+
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 | 24.8168 | 2s | 26.8989 | 0.6237624299158894E+00 |
2 | 1s | 26.0000 | 2s | 26.8989 | -0.1572158025318240E-01 |
3 | 2s | 24.8168 | 1s | 26.0000 | 0.1211082081787754E-01 |
4 | 1s | 26.0000 | 1s | 26.0000 | -0.4316836106102013E-03 |
5 | 2s | 30.6185 | 3s | 51.2522 | 0.1890613235273052E-02 |
6 | 1s | 26.0000 | 3s | 51.2522 | 0.1905001329148994E-03 |
7 | 2s | 30.6185 | 1s | 26.0000 | 0.2147445623730585E-03 |
8 | 1s | 26.0000 | 1s | 26.0000 | 0.3060058736905041E-04 |
9 | 3s | 53.9515 | 4s | 56.7357 | -0.1027357961133932E-02 |
10 | 1s | 26.0000 | 4s | 56.7357 | -0.1131101754797140E-03 |
11 | 3s | 53.9515 | 1s | 26.0000 | -0.5932556702203296E-04 |
12 | 1s | 26.0000 | 1s | 26.0000 | -0.9237124158246011E-05 |
13 | 2p | 26.0725 | 2p | 24.8416 | 0.3393755092677939E+00 |
14 | 2p | 21.7836 | 4p | 42.3901 | -0.6055043690677595E-03 |
15 | 2p | 44.5920 | 4p | 83.7026 | 0.2144656742746069E-02 |
16 | 3d | 83.0569 | 3d | 83.0569 | 0.1269548194131908E-02 |
17 | 3d | 67.2445 | 4d | 149.8779 | -0.3553646346992032E-03 |
18 | 4f | 142.2655 | 4f | 142.2655 | -0.3576477647539176E-03 |
19 | 2p | 68.3063 | 2p | 68.3063 | -0.3576649954552013E-03 |
20 | 2p | 139.8140 | 3p | 145.7946 | 0.1067579689423436E-03 |
21 | 4p | 207.6374 | 4p | 207.6374 | -0.3146896956328780E-05 |
22 | 2p | 79.6409 | 4p | 183.9782 | -0.4419849615134033E-05 |
23 | 3p | 362.5057 | 4p | 352.6967 | 0.1031049436999424E-04 |
24 | 3d | 179.4373 | 3d | 179.4373 | -0.3101466685713243E-04 |
25 | 4d | 275.0511 | 4d | 275.0511 | -0.7749319815610018E-05 |
26 | 5d | 379.2032 | 5d | 379.2032 | 0.3893820357205893E-05 |
27 | 3d | 89.9112 | 5d | 250.1446 | 0.1293259555301649E-04 |
28 | 4f | 298.3732 | 4f | 298.3732 | 0.1498013833963153E-04 |
29 | 5f | 390.2440 | 5f | 390.2440 | -0.8451937914155596E-05 |
30 | 5g | 435.0899 | 5g | 435.0899 | 0.1783976543633407E-04 |
31 | 1s | 23.3038 | 1s | 28.0306 | 0.2169257724631150E-03 |
32 | 1s | 38.2491 | 4s | 141.5886 | 0.1526537182583194E-05 |
33 | 1s | 56.7368 | 2s | 84.8446 | -0.6572850905632384E-06 |
34 | 2s | 86.2275 | 4s | 183.9887 | 0.6931042565179003E-06 |
35 | 1s | 32.8656 | 3s | 69.3931 | -0.1250678891295624E-05 |
36 | 1s | 46.6874 | 2s | 65.4933 | 0.1429540840531928E-05 |
37 | 2s | 92.8525 | 3s | 136.0934 | -0.2862075934672598E-06 |
38 | 3s | 155.5020 | 4s | 164.0344 | -0.1951102579946206E-06 |
39 | 4s | 217.0086 | 5s | 235.7415 | -0.1120119859064839E-06 |
40 | 1s | 26.0092 | 2s | 25.0785 | 0.9344587310240117E-03 |
41 | 1s | 16.9631 | 2s | 55.9725 | 0.8316682706113704E-05 |
42 | 1s | 25.9871 | 3s | 25.1370 | 0.3995060915941291E-03 |
43 | 1s | 25.9955 | 4s | 25.1284 | 0.2570600557301919E-04 |
44 | 1s | 25.9955 | 5s | 25.1028 | 0.4464047540246038E-04 |
Energy= -165.83185050 a.u.