RETURN

(1s 2 2s 2 2p 2 5p 1 ) 2 P             Ar 11+

F( r ) = Σ j   C j   S nl ( α j ,r) Y l,m ( r )

Table 2151.

N.V.Novikov // Wave Function Value Database;

http://cdfe.sinp.msu.ru/services/wftables/

j S nl j j ,r) C j
nl j α j 5p- electron
1 2p 4.632820 .47924165
2 3p 2.859522 -3.67078881
3 4p 2.548917 8.23283663
4 5p 2.469755 -5.66138234
5 2p 11.402802 .03702812
6 5p 48.856271 -.00014798
7 4p 88.448001 -.00001433
ORB.ENERGY,a.u. -3.040800
NORM 1.000000
< R > 2.883114
< R2 > 9.349061
< 1/R > .494341
< 1/R**2 > .807263


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 7.510308 1.19580654
2 3p 9.597860 -.23985727
3 4p 11.614158 .04407872
4 5p 3.058883 .06533882
5 4p 2.299680 -.06568868
6 5p 32.199482 -.00161053
7 4p 41.526014 -.00082435
8 3p 58.803834 -.00006657
ORB.ENERGY,a.u. -24.690000
NORM 1.000000
< R > .327893
< R2 > .130978
< 1/R > 3.860493
< 1/R**2 > 20.180166


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 14.057697 .43784074
2 2s 7.994558 -.87214328
3 3s 8.205753 -.28697737
4 4s 30.554521 .00186037
5 3s 16.474900 .01696242
6 5s 8.269638 -.02083940
ORB.ENERGY,a.u. -23.662000
NORM 1.000000
< R > .378519
< R2 > .167776
< 1/R > 3.884046
< 1/R**2 > 61.147784


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.067563 .92683816
2 1s 25.713461 .07171629
3 2s 15.745015 .01938292
4 3s 19.683257 -.01555181
5 5s 42.309011 .00077960
6 4s 99.809496 -.00003490
7 5s 12.832519 .00021036
ORB.ENERGY,a.u. -133.590000
NORM 1.000000
< R > .085568
< R2 > .009809
< 1/R > 17.623338
< 1/R**2 > 624.983178


Total Energy= -433.46492371 a.u.

Kinetic Energy= 433.43558595 a.u.

Potential Energy= -866.90050966 a.u.

Virial Ratio = -2.00006769

***** TESTING *****

1.0 - <5p 5p> = -.3573E-06

1.0 - <2p 2p> = .1659E-07

1.0 - <2s 2s> = .1134E-07

1.0 - <1s 1s> = .2634E-08

<5p 2p> = -.2816E-05

<2s 1s> = .2473E-06

RETURN