RETURN

(1s 1 5d 1 ) 1 D             F 7+

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

Table 1252.

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 5d- electron
1 3d 1.600643 3.54405682
2 4d 1.600201 -8.85359780
3 5d 1.599930 5.99961333
4 3d 4.292341 .00112315
5 5d 2.551937 .00570492
6 4d 6.425842 -.00101599
7 5d 15.972723 -.00013548
ORB.ENERGY,a.u. -1.323600
NORM 1.000002
< R > 4.313495
< R2 > 21.102790
< 1/R > .319867
< 1/R**2 > .204515


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 8.855568 .75724005
2 1s 9.102480 .25653005
3 2s 8.917968 -.01575904
4 3s 8.550289 -.00016441
ORB.ENERGY,a.u. -40.204000
NORM 1.000000
< R > .166664
< R2 > .037035
< 1/R > 9.000091
< 1/R**2 > 162.002488


Total Energy= -41.78415555 a.u.

Kinetic Energy= 41.77975056 a.u.

Potential Energy= -83.56390612 a.u.

Virial Ratio = -2.00010543

***** TESTING *****

1.0 - <5d 5d> = -.2354E-05

1.0 - <1s 1s> = -.1152E-07

RETURN