RETURN

(1s 2 2s 2 2p 4 4s 1 ) 4 P             Ar 9+

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

Table 4140.

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 14.437804 .10934505
2 2s 3.549271 -1.56774249
3 3s 3.589167 3.10027235
4 4s 2.742441 -1.98903859
5 5s 5.247903 -.18321658
6 4s 15.328037 -.01370782
7 5s 35.348509 -.00020965
8 5s 1.954144 .00281990
9 4s 56.482568 -.00008091
ORB.ENERGY,a.u. -3.817000
NORM .999999
< R > 1.979803
< R2 > 4.402861
< 1/R > .725629
< 1/R**2 > 4.271891


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 6.511843 1.12775177
2 3p 7.288501 -.20449745
3 2p 13.629072 .07260144
4 4p 16.161107 .01098775
5 5p 44.985876 -.00012103
6 5p 5.130578 -.00081995
ORB.ENERGY,a.u. -19.100000
NORM 1.000000
< R > .348101
< R2 > .147956
< 1/R > 3.667976
< 1/R**2 > 18.411183


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 15.560636 .36103360
2 2s 6.762087 -.78717301
3 3s 10.005496 -.24213258
4 4s 8.074621 -.05620256
5 5s 21.405524 -.00759316
6 4s 2.280463 .01955939
7 3s 1.729773 -.01931962
8 3s 88.108532 -.00001013
9 5s 1.782922 .00259721
10 4s 70.440981 -.00004378
ORB.ENERGY,a.u. -20.023000
NORM 1.000000
< R > .393377
< R2 > .181903
< 1/R > 3.729146
< 1/R**2 > 56.743186


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.131957 .92033922
2 1s 24.476314 .07685457
3 2s 9.238227 .02302735
4 3s 11.409629 -.02539985
5 4s 14.484235 .00991542
6 5s 44.015443 .00065693
7 4s 101.054628 -.00002838
8 5s 2.354394 -.00020210
ORB.ENERGY,a.u. -127.520000
NORM 1.000000
< R > .085840
< R2 > .009885
< 1/R > 17.587501
< 1/R**2 > 623.007527


Total Energy= -476.71072334 a.u.

Kinetic Energy= 476.72239501 a.u.

Potential Energy= -953.43311835 a.u.

Virial Ratio = -1.99997552

***** TESTING *****

1.0 - <4s 4s> = .5771E-06

1.0 - <2p 2p> = .6516E-08

1.0 - <2s 2s> = -.2076E-07

1.0 - <1s 1s> = .1330E-07

<4s 2s> = .5603E-06

<4s 1s> = -.8806E-05

<2s 1s> = .4296E-06

RETURN