RETURN

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

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

Table 2131.

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 5.444786 .47602352
2 3p 3.559066 -1.00490810
3 4p 4.167099 -.21160806
4 2p 11.547123 .06878082
5 5p 19.692395 .00131082
6 5p 44.854745 -.00016208
7 4p 66.512115 -.00003028
ORB.ENERGY,a.u. -6.450400
NORM 1.000000
< R > 1.094673
< R2 > 1.353448
< 1/R > 1.182352
< 1/R**2 > 2.777307


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 6.952138 1.35343751
2 3p 8.680847 -.45593620
3 4p 10.115854 .10064949
4 5p 4.614853 -.01608627
5 5p 16.607515 .00391853
6 4p 29.802953 -.00142703
7 4p 3.138442 -.00169793
8 3p 34.849317 -.00037055
ORB.ENERGY,a.u. -18.342000
NORM 1.000000
< R > .344752
< R2 > .144219
< 1/R > 3.686818
< 1/R**2 > 18.546810


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 14.216965 .41257034
2 2s 7.775795 -.85897126
3 3s 7.385124 -.29994011
4 4s 12.055888 .00493098
5 3s 17.243153 .01422794
6 5s 39.131749 .00069413
7 5s 6.971876 -.01064343
8 3s 74.400845 -.00002433
ORB.ENERGY,a.u. -20.023000
NORM 1.000000
< R > .394156
< R2 > .182687
< 1/R > 3.721614
< 1/R**2 > 56.532011


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.131956 .92040766
2 1s 24.667212 .07583552
3 2s 11.454313 .01994240
4 3s 13.776321 -.02006225
5 4s 16.386942 .00908809
6 5s 43.887499 .00067641
7 4s 100.848120 -.00002812
ORB.ENERGY,a.u. -127.520000
NORM 1.000000
< R > .085862
< R2 > .009891
< 1/R > 17.584557
< 1/R**2 > 622.846447


Total Energy= -479.52547793 a.u.

Kinetic Energy= 479.35909699 a.u.

Potential Energy= -958.88457492 a.u.

Virial Ratio = -2.00034709

***** TESTING *****

1.0 - <3p 3p> = .5276E-07

1.0 - <2p 2p> = -.1050E-08

1.0 - <2s 2s> = .1393E-07

1.0 - <1s 1s> = .1174E-07

<3p 2p> = -.1776E-07

<2s 1s> = -.1030E-05

RETURN