RETURN

(1s 2 2s 2 2p 1 5p 1 ) 1 P             Ar 12+

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

Table 1151.

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 5.961150 .39710420
2 3p 3.012133 -3.49752610
3 4p 2.658169 9.83367757
4 5p 2.680916 -7.24898277
5 2p 11.992473 .02255772
6 5p 5.040750 -.15159241
7 5p 38.584338 -.00042073
8 4p 57.968758 -.00007834
ORB.ENERGY,a.u. -3.571600
NORM .999998
< R > 2.661726
< R2 > 7.968514
< 1/R > .544372
< 1/R**2 > 1.025583


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 7.618583 1.07690272
2 3p 9.028972 -.09036448
3 2p 18.255383 .01293641
4 5p 23.288505 .00239293
5 4p 5.769830 .00047756
ORB.ENERGY,a.u. -27.231000
NORM 1.000000
< R > .320026
< R2 > .123766
< 1/R > 3.941409
< 1/R**2 > 20.963762


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 15.369801 .39063761
2 2s 7.032080 -.81731632
3 3s 10.037854 -.28746615
4 4s 33.209367 .00125667
5 5s 19.407189 -.00795390
6 5s 7.763278 .01730928
ORB.ENERGY,a.u. -26.841000
NORM 1.000000
< R > .371550
< R2 > .161406
< 1/R > 3.962143
< 1/R**2 > 63.417011


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.203247 .93918494
2 1s 26.413140 .05725092
3 2s 15.941577 .02002207
4 3s 19.479336 -.01403516
5 4s 88.917302 -.00005671
6 5s 41.147962 .00066467
7 4s 7.152517 .00002637
ORB.ENERGY,a.u. -137.760000
NORM 1.000000
< R > .085405
< R2 > .009764
< 1/R > 17.645069
< 1/R**2 > 626.186182


Total Energy= -408.75793386 a.u.

Kinetic Energy= 408.77944795 a.u.

Potential Energy= -817.53738181 a.u.

Virial Ratio = -1.99994737

***** TESTING *****

1.0 - <5p 5p> = .2262E-05

1.0 - <2p 2p> = .1073E-07

1.0 - <2s 2s> = -.1113E-07

1.0 - <1s 1s> = -.2050E-08

<5p 2p> = -.7422E-05

<2s 1s> = .2073E-07

RETURN