RETURN

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

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

Table 5151.

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 5.082394 .32881228
2 3p 2.808306 -2.75060001
3 4p 2.468285 6.04442941
4 5p 2.292877 -4.21706695
5 2p 10.384901 .05511501
6 5p 34.048222 -.00055091
7 4p 50.078180 -.00013314
ORB.ENERGY,a.u. -2.635800
NORM 1.000001
< R > 3.050158
< R2 > 10.461217
< 1/R > .473667
< 1/R**2 > .797940


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 7.273712 1.25034759
2 3p 9.468103 -.32489737
3 4p 11.978906 .06840064
4 5p 23.336755 .00364107
5 4p 4.230609 .00177975
6 5p 23.405741 -.00053102
7 5p 3.789821 -.00399646
8 3p 2.735843 .00413342
ORB.ENERGY,a.u. -22.354000
NORM 1.000000
< R > .336851
< R2 > .137896
< 1/R > 3.769732
< 1/R**2 > 19.328186


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 14.087562 .42777024
2 2s 7.910850 -.87071759
3 3s 7.729301 -.29128393
4 4s 30.933602 .00181658
5 3s 16.199341 .01655143
6 5s 7.884057 -.01347997
ORB.ENERGY,a.u. -21.808000
NORM 1.000000
< R > .385751
< R2 > .174547
< 1/R > 3.806527
< 1/R**2 > 58.925356


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.184390 .94511511
2 1s 26.903688 .05233297
3 2s 15.392880 .01876088
4 3s 21.571801 -.01475463
5 4s 32.445758 .00255809
6 5s 61.036720 .00010872
7 5s 12.723244 .00039334
ORB.ENERGY,a.u. -130.480000
NORM 1.000000
< R > .085716
< R2 > .009850
< 1/R > 17.603760
< 1/R**2 > 623.903069


Total Energy= -455.80512605 a.u.

Kinetic Energy= 455.81740282 a.u.

Potential Energy= -911.62252886 a.u.

Virial Ratio = -1.99997307

***** TESTING *****

1.0 - <5p 5p> = -.5257E-06

1.0 - <2p 2p> = -.4933E-08

1.0 - <2s 2s> = .1550E-07

1.0 - <1s 1s> = -.1388E-07

<5p 2p> = -.1166E-05

<2s 1s> = .8912E-07

RETURN