RETURN

(1s5s) 1 S       Z=25       Mn 23+

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 24.9985 5s 24.1045 0.9999870361984010E+00
2 2s 102.0672 4s 184.4206 0.3281965825798124E-05
3 2s 110.6273 3s 135.4627 0.1640938020665880E-03
4 3s 154.4752 4s 164.5495 0.3378712685460293E-04
5 4s 216.4462 5s 232.4848 0.8137037177003745E-05
6 2p 65.5783 2p 65.5783 0.2494669966687316E-03
7 2p 132.8361 3p 141.9462 0.1049283898922056E-03
8 4p 200.1300 4p 200.1300 -0.2103704765852108E-04
9 2p 77.4495 4p 177.1722 -0.2121378095935636E-03
10 3p 349.3934 4p 339.8462 0.2077466253685831E-04
11 3d 172.5092 3d 172.5092 -0.5542015324860971E-04
12 4d 264.5017 4d 264.5017 0.3737201032201774E-04
13 5d 364.6693 5d 364.6693 0.4142194029409766E-05
14 3d 86.4213 5d 240.6528 0.1046550731859525E-03
15 4f 286.7781 4f 286.7781 0.1992829273974079E-04
16 5f 375.0614 5f 375.0614 -0.1769787397432025E-05
17 5g 418.4803 5g 418.4803 -0.8176150284329583E-05
18 1s 22.3275 1s 26.9525 -0.2014418194417179E-02
19 1s 39.9344 4s 143.4429 -0.4678700496519303E-05
20 1s 61.7609 2s 85.0833 0.3787106205504296E-05
21 1s 31.5549 3s 68.6536 0.1299358271743254E-04
22 1s 39.3930 2s 64.6914 -0.1524914573173805E-04
23 1s 25.0089 2s 24.0813 -0.7681694947904562E-03
24 1s 16.2653 2s 55.4643 -0.6506395620875163E-05
25 1s 24.9904 3s 24.1455 -0.9793269085167857E-03
26 1s 24.9904 4s 24.1291 -0.2027096331236137E-02

Energy= -324.04981689 a.u.

RETURN