RETURN

(1s 1 5s 1 ) 3 S             He 0

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

Table 3050.

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 5s- electron
1 1s 2.224480 .03480941
2 2s .209194 -3.74821918
3 3s .308148 4.62753279
4 4s .184053 -7.96481872
5 5s .201900 8.23338555
6 2s 1.619310 .03397793
7 5s 4.238686 -.00072572
8 3s 11.664098 .00004406
9 5s .076599 .00242645
ORB.ENERGY,a.u. -.022690
NORM .999983
< R > 33.239663
< R2 > 1237.838688
< 1/R > .043197
< 1/R**2 > .015749


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 1.944652 .75215502
2 1s 2.093810 .26038172
3 2s 1.912406 -.01326856
4 3s 2.147270 -.00130653
ORB.ENERGY,a.u. -1.942700
NORM 1.000000
< R > .749962
< R2 > .749938
< 1/R > 2.000115
< 1/R**2 > 8.000850


Total Energy= -2.02226262 a.u.

Kinetic Energy= 2.02257984 a.u.

Potential Energy= -4.04484247 a.u.

Virial Ratio = -1.99984316

***** TESTING *****

1.0 - <5s 5s> = .1665E-04

1.0 - <1s 1s> = .1899E-08

<5s 1s> = .4230E-06

RETURN