RETURN

(2s2s) 1 S       Z=12       Mg 10+

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 11.1522 2s 12.5631 0.6258935271103245E+00
2 1s 12.0000 2s 12.5631 -0.2434789944763014E-01
3 2s 11.1522 1s 12.0000 0.1651946646955900E-01
4 1s 12.0000 1s 12.0000 -0.9088078170880609E-03
5 2s 14.1819 3s 23.9022 0.4051039990088415E-02
6 1s 12.0000 3s 23.9022 0.4178397014345939E-03
7 2s 14.1819 1s 12.0000 0.4581504499195352E-03
8 1s 12.0000 1s 12.0000 0.6682920385719578E-04
9 3s 24.6007 4s 25.9692 -0.2239421135272046E-02
10 1s 12.0000 4s 25.9692 -0.2489468379885582E-03
11 3s 24.6007 1s 12.0000 -0.1305455296374732E-03
12 1s 12.0000 1s 12.0000 -0.2052333074675823E-04
13 2p 12.0331 2p 10.9183 0.3433630227728594E+00
14 2p 10.6700 4p 20.3143 -0.2112419213138033E-02
15 2p 20.6144 4p 38.9170 0.4059086658662207E-02
16 3d 37.0556 3d 37.0556 0.2786874071909423E-02
17 3d 29.3849 4d 67.9574 -0.6822332494788787E-03
18 4f 64.8086 4f 64.8086 -0.7337757727105701E-03
19 2p 31.1072 2p 31.1072 -0.5910693204047152E-03
20 2p 63.2794 3p 67.1562 0.2244967473682593E-03
21 4p 94.7003 4p 94.7003 -0.7618763524580386E-05
22 2p 36.8730 4p 84.0546 -0.2562281992950812E-04
23 3p 164.8522 4p 160.5737 0.2250146431967354E-04
24 3d 81.8852 3d 81.8852 -0.7136054292262477E-04
25 4d 125.5823 4d 125.5823 -0.2176401220998862E-04
26 5d 173.2181 5d 173.2181 0.1149769087620259E-04
27 3d 41.2181 5d 114.2482 -0.4238346619419526E-05
28 4f 136.2821 4f 136.2821 0.2993814385594451E-04
29 5f 178.1876 5f 178.1876 -0.1695243621099641E-04
30 5g 198.8385 5g 198.8385 0.3631154662678501E-04
31 1s 10.4524 1s 12.9392 0.3957519392973449E-03
32 1s 17.8501 4s 87.2557 0.2200442869982967E-05
33 1s 31.2194 2s 35.6206 -0.1642370548083981E-05
34 2s 89.9888 4s 87.8023 0.2185548010503715E-05
35 1s 17.1351 3s 32.1846 -0.8638676489643525E-05
36 1s 20.3782 2s 50.5189 0.2105400317061875E-05
37 2s 52.0612 3s 68.6913 -0.1815821014529817E-05
38 3s 90.3573 4s 83.1046 -0.3042215652111550E-05
39 4s 103.0682 5s 118.1033 -0.5405141151962337E-06
40 1s 11.9816 2s 11.0775 0.1920966348042872E-02
41 1s 8.5704 2s 27.9152 0.3453194014909585E-04
42 1s 11.9890 3s 11.1429 0.9547185993481332E-03
43 1s 11.9949 4s 11.1249 0.5206434776899779E-04
44 1s 11.9987 5s 11.1015 0.1715199148676755E-04

Energy= -34.55263649 a.u.

RETURN