RETURN

(1s 2 2s 2 2p 5 4s 1 ) 3 P             Ar 8+

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

Table 3140.

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 4s- electron
1 1s 14.939930 .09525044
2 2s 3.446950 -1.32665757
3 3s 3.399293 2.77555200
4 4s 2.527395 -1.86150808
5 5s 4.921958 -.22041791
6 4s 14.850894 -.02267247
7 5s 29.623667 -.00188804
8 4s 41.461964 -.00033102
9 5s 1.841785 .00243851
10 3s 32.984951 -.00044648
ORB.ENERGY,a.u. -3.207200
NORM 1.000000
< R > 2.121673
< R2 > 5.056119
< 1/R > .671032
< 1/R**2 > 3.629144


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 6.378937 1.17358195
2 3p 7.506066 -.23634974
3 2p 14.023633 .06137537
4 4p 17.072997 .00936113
5 5p 3.470540 -.00029880
6 4p 4.383702 .00081195
7 4p 71.142868 .00002140
ORB.ENERGY,a.u. -17.004000
NORM 1.000000
< R > .359150
< R2 > .158222
< 1/R > 3.574053
< 1/R**2 > 17.583316


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 15.729911 .34828645
2 2s 6.525573 -.78549126
3 3s 10.298873 -.22982482
4 4s 8.203905 -.06542880
5 5s 21.995077 -.00641351
6 5s 2.952375 .00699168
7 4s 2.718863 -.00624705
8 3s 48.365073 -.00008151
ORB.ENERGY,a.u. -18.309000
NORM 1.000000
< R > .400862
< R2 > .189282
< 1/R > 3.656231
< 1/R**2 > 54.713610


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.191273 .93030583
2 1s 25.102634 .06520399
3 2s 10.136135 .02340563
4 3s 12.487108 -.02394778
5 4s 15.867086 .01083118
6 5s 42.657955 .00063548
7 4s 95.929862 -.00003763
8 5s 2.046478 -.00008706
ORB.ENERGY,a.u. -124.690000
NORM 1.000000
< R > .085956
< R2 > .009918
< 1/R > 17.572443
< 1/R**2 > 622.183072


Total Energy= -493.67331232 a.u.

Kinetic Energy= 493.67849670 a.u.

Potential Energy= -987.35180903 a.u.

Virial Ratio = -1.99998950

***** TESTING *****

1.0 - <4s 4s> = -.1092E-06

1.0 - <2p 2p> = -.6276E-08

1.0 - <2s 2s> = -.8385E-08

1.0 - <1s 1s> = -.2160E-07

<4s 2s> = .3736E-06

<4s 1s> = -.8609E-05

<2s 1s> = .3401E-06

RETURN