RETURN

(1s 2 2s 2 2p 4 3p 1 ) 4 P             Ar 9+

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

Table 4131.

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 3p- electron
1 2p 6.216498 .48571741
2 3p 3.738738 -.93306875
3 4p 4.209873 -.23174151
4 2p 11.543272 .07470489
5 5p 18.168424 .00459410
6 5p 48.914149 -.00019825
7 4p 76.179002 -.00002916
8 5p 3.487302 -.00787683
ORB.ENERGY,a.u. -6.754100
NORM 1.000000
< R > 1.029182
< R2 > 1.216396
< 1/R > 1.336628
< 1/R**2 > 3.816562


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 6.255260 1.20263238
2 3p 6.893390 -.29691856
3 2p 13.376679 .08184620
4 4p 15.897976 .01215009
5 5p 45.616591 -.00011421
6 5p 4.066811 .00128592
ORB.ENERGY,a.u. -18.645000
NORM 1.000000
< R > .349570
< R2 > .149483
< 1/R > 3.657561
< 1/R**2 > 18.325246


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 14.195440 .41338788
2 2s 7.792708 -.85907799
3 3s 7.368655 -.30030294
4 4s 12.664755 .00419337
5 3s 17.236014 .01464192
6 5s 39.178357 .00067705
7 5s 7.016430 -.01113468
8 4s 4.775114 -.00017448
9 3s 73.106519 -.00002399
ORB.ENERGY,a.u. -20.023000
NORM 1.000000
< R > .394308
< R2 > .182855
< 1/R > 3.720433
< 1/R**2 > 56.500742


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.133363 .92057178
2 1s 24.672704 .07564397
3 2s 11.458740 .01991077
4 3s 13.796998 -.02002161
5 4s 16.445206 .00909487
6 5s 43.823614 .00069375
7 4s 102.309257 -.00002709
ORB.ENERGY,a.u. -127.520000
NORM 1.000000
< R > .085863
< R2 > .009891
< 1/R > 17.584405
< 1/R**2 > 622.837081


Total Energy= -479.55396321 a.u.

Kinetic Energy= 479.66132866 a.u.

Potential Energy= -959.21529187 a.u.

Virial Ratio = -1.99977616

***** TESTING *****

1.0 - <3p 3p> = -.4718E-07

1.0 - <2p 2p> = .4223E-08

1.0 - <2s 2s> = .1321E-07

1.0 - <1s 1s> = .5647E-08

<3p 2p> = -.3033E-07

<2s 1s> = -.8116E-06

RETURN