RETURN

(1s 2 2s 2 2p 5 3p 1 ) 1 P             Ar 8+

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

Table 1131.

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 5.541819 .57306786
2 3p 3.356043 -1.20568726
3 4p 8.664165 -.06753383
4 2p 12.810386 .04989490
5 5p 22.317683 .00189716
6 5p 3.439702 .01294536
7 3p 37.912258 -.00002434
ORB.ENERGY,a.u. -5.566700
NORM 1.000000
< R > 1.122368
< R2 > 1.441374
< 1/R > 1.208427
< 1/R**2 > 3.135767


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 6.327342 1.18463002
2 3p 7.386973 -.25025324
3 2p 13.860328 .06463878
4 4p 17.042158 .00805717
5 5p 5.000621 .00107719
6 5p 41.681749 -.00014318
ORB.ENERGY,a.u. -16.393000
NORM 1.000000
< R > .359786
< R2 > .158877
< 1/R > 3.569374
< 1/R**2 > 17.543947


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 14.310174 .40045577
2 2s 7.685994 -.84639876
3 3s 7.008650 -.30631490
4 4s 17.681024 .00415791
5 3s 18.911609 .00791521
6 5s 36.031716 .00110760
7 5s 6.352310 -.00573952
8 4s 42.968377 .00032231
ORB.ENERGY,a.u. -18.309000
NORM 1.000000
< R > .401815
< R2 > .190282
< 1/R > 3.647704
< 1/R**2 > 54.479821


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.187182 .93142973
2 1s 25.274209 .06402728
3 2s 10.964238 .02175179
4 3s 13.419470 -.02190334
5 4s 16.490946 .01079324
6 5s 42.991932 .00052867
7 4s 89.009810 -.00004851
ORB.ENERGY,a.u. -124.690000
NORM 1.000000
< R > .085974
< R2 > .009923
< 1/R > 17.570037
< 1/R**2 > 622.051124


Total Energy= -496.06507525 a.u.

Kinetic Energy= 496.04021869 a.u.

Potential Energy= -992.10529395 a.u.

Virial Ratio = -2.00005011

***** TESTING *****

1.0 - <3p 3p> = .1001E-06

1.0 - <2p 2p> = .2378E-07

1.0 - <2s 2s> = .1979E-07

1.0 - <1s 1s> = .3002E-08

<3p 2p> = -.1256E-05

<2s 1s> = -.1535E-05

RETURN