RETURN

(1s 1 5p 1 ) 1 P             O 6+

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 2.043135 1.11294973
2 3p 1.479254 -6.95487554
3 4p 1.388814 13.61976057
4 5p 1.387228 -8.57147023
5 3p 8.432900 -.00430668
6 2p .780702 .19299054
7 5p 4.024338 .01901532
8 4p 20.183851 -.00016192
9 3p .577093 -.00770709
ORB.ENERGY,a.u. -1.004600
NORM 1.000006
< R > 5.229844
< R2 > 30.797265
< 1/R > .279409
< 1/R**2 > .260550


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 7.868772 .75740091
2 1s 8.102567 .25624305
3 2s 7.907130 -.01563528
4 3s 8.940415 -.00015151
5 4s 5.164654 .00008624
ORB.ENERGY,a.u. -31.725000
NORM 1.000000
< R > .187501
< R2 > .046877
< 1/R > 8.000147
< 1/R**2 > 128.005302


Total Energy= -32.98534863 a.u.

Kinetic Energy= 32.97703535 a.u.

Potential Energy= -65.96238398 a.u.

Virial Ratio = -2.00025209

***** TESTING *****

1.0 - <5p 5p> = -.6122E-05

1.0 - <1s 1s> = .5365E-08

RETURN