RETURN

(1s 2 2s 2 2p 3 4p 1 ) 5 P             Ar 10+

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

Table 5141.

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 4p- electron
1 2p 8.871255 .23141715
2 3p 2.030906 2.17521378
3 4p 4.258592 -1.57084139
4 5p 7.350001 -.12489468
5 3p 23.525114 -.00143287
6 5p 2.342653 -.71291269
7 4p 2.743284 .41222503
8 3p 32.010878 .00025054
9 3p .756163 -.00040545
ORB.ENERGY,a.u. -4.219600
NORM 1.000000
< R > 1.876973
< R2 > 3.985816
< 1/R > .756031
< 1/R**2 > 1.616243


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 7.266070 1.25293121
2 3p 9.451958 -.32814896
3 4p 11.982350 .06902681
4 5p 23.347680 .00329197
5 4p 4.570990 .00406636
6 5p 23.303000 -.00023279
7 5p 4.170268 -.00187360
ORB.ENERGY,a.u. -22.093000
NORM 1.000000
< R > .337050
< R2 > .138081
< 1/R > 3.768068
< 1/R**2 > 19.313608


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 14.075164 .42803212
2 2s 7.918882 -.87058378
3 3s 7.735461 -.29122880
4 4s 30.958379 .00181959
5 3s 16.056290 .01740686
6 5s 7.910235 -.01556310
7 4s 2.605580 .00016208
ORB.ENERGY,a.u. -21.808000
NORM 1.000000
< R > .386020
< R2 > .174808
< 1/R > 3.803818
< 1/R**2 > 58.848470


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.183760 .94515368
2 1s 26.910452 .05229986
3 2s 15.383252 .01876768
4 3s 21.581142 -.01475360
5 4s 32.422853 .00255816
6 5s 61.273577 .00010824
7 5s 12.876724 .00038954
ORB.ENERGY,a.u. -130.480000
NORM 1.000000
< R > .085721
< R2 > .009851
< 1/R > 17.603028
< 1/R**2 > 623.861915


Total Energy= -457.37225536 a.u.

Kinetic Energy= 457.39895028 a.u.

Potential Energy= -914.77120565 a.u.

Virial Ratio = -1.99994164

***** TESTING *****

1.0 - <4p 4p> = .4562E-06

1.0 - <2p 2p> = -.1197E-07

1.0 - <2s 2s> = -.1246E-07

1.0 - <1s 1s> = -.1300E-07

<4p 2p> = .1059E-05

<2s 1s> = .1084E-06

RETURN