RETURN

(1s 2 2s 2 2p 4 4s 1 ) 2 P             Ar 9+

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

Table 2140.

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 4s- electron
1 1s 14.534739 .10346511
2 2s 3.480843 -1.53181144
3 3s 3.499589 3.12907280
4 4s 2.732770 -2.07018929
5 5s 5.045118 -.15954404
6 4s 15.638968 -.01123310
7 5s 31.155055 -.00044343
8 5s 2.315510 .00646260
9 4s 51.733704 -.00011250
ORB.ENERGY,a.u. -3.783400
NORM 1.000000
< R > 1.996976
< R2 > 4.477094
< 1/R > .709657
< 1/R**2 > 3.933747


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 6.506859 1.12972644
2 3p 7.289417 -.20546532
3 2p 13.627155 .07264875
4 4p 16.265934 .01059737
5 5p 45.246770 -.00012356
6 5p 6.652841 -.00176562
ORB.ENERGY,a.u. -19.067000
NORM 1.000000
< R > .348111
< R2 > .147959
< 1/R > 3.667789
< 1/R**2 > 18.409551


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 15.495011 .36407148
2 2s 6.838929 -.78658994
3 3s 9.887291 -.24295828
4 4s 7.840299 -.06508951
5 5s 21.275722 -.00775540
6 5s 2.961356 -.00616476
7 3s 4.236859 .00779453
8 3s 63.273810 -.00007136
9 4s 116.323344 .00001048
ORB.ENERGY,a.u. -20.023000
NORM 1.000000
< R > .392601
< R2 > .181207
< 1/R > 3.736835
< 1/R**2 > 56.959203


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.140066 .92041489
2 1s 24.523311 .07617865
3 2s 9.856487 .02249464
4 3s 11.808709 -.02306090
5 4s 14.494875 .00899960
6 5s 44.934506 .00054215
7 4s 91.673664 -.00003578
8 5s 3.271935 .00136252
9 4s 3.237468 -.00116074
ORB.ENERGY,a.u. -127.520000
NORM 1.000000
< R > .085848
< R2 > .009888
< 1/R > 17.586483
< 1/R**2 > 622.952861


Total Energy= -476.71026614 a.u.

Kinetic Energy= 476.68892234 a.u.

Potential Energy= -953.39918848 a.u.

Virial Ratio = -2.00004478

***** TESTING *****

1.0 - <4s 4s> = -.2761E-06

1.0 - <2p 2p> = -.2094E-08

1.0 - <2s 2s> = .6144E-08

1.0 - <1s 1s> = -.5291E-09

<4s 2s> = -.2229E-06

<4s 1s> = .7255E-06

<2s 1s> = .7955E-07

RETURN