RETURN

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

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

Table 2141.

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 9.002364 .17849504
2 3p 2.182124 2.48286144
3 4p 3.807310 -1.96642827
4 5p 6.726263 -.18946041
5 3p 18.773032 -.00150678
6 5p 2.016384 -.13955598
7 4p 94.745244 .00000250
8 4p 1.312667 .03812981
9 3p .994113 -.01759470
ORB.ENERGY,a.u. -3.479300
NORM .999999
< R > 2.068728
< R2 > 4.837501
< 1/R > .668696
< 1/R**2 > 1.199653


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 6.891497 1.20699186
2 3p 8.559142 -.22445399
3 2p 20.736918 .01103479
4 4p 21.517863 .00826678
5 5p 2.892930 .01683197
6 4p 3.330705 -.00906341
7 3p 28.868767 .00179668
ORB.ENERGY,a.u. -19.012000
NORM 1.000000
< R > .347384
< R2 > .147616
< 1/R > 3.674050
< 1/R**2 > 18.459628


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 14.198871 .41415406
2 2s 7.804408 -.86001877
3 3s 7.370342 -.30054261
4 4s 14.326584 .00497905
5 3s 18.219092 .01361108
6 5s 39.242699 .00052451
7 5s 7.202848 -.00886911
8 4s 3.511026 .00034834
9 2s 102.697188 .00000491
ORB.ENERGY,a.u. -20.023000
NORM 1.000000
< R > .393362
< R2 > .181870
< 1/R > 3.728912
< 1/R**2 > 56.733194


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.131794 .92021242
2 1s 24.636275 .07615568
3 2s 11.287987 .02011409
4 3s 13.634786 -.02037990
5 4s 16.310922 .00900307
6 5s 44.073605 .00068457
7 4s 101.533929 -.00002661
ORB.ENERGY,a.u. -127.520000
NORM 1.000000
< R > .085848
< R2 > .009887
< 1/R > 17.586369
< 1/R**2 > 622.946978


Total Energy= -476.45305556 a.u.

Kinetic Energy= 476.39157530 a.u.

Potential Energy= -952.84463086 a.u.

Virial Ratio = -2.00012905

***** TESTING *****

1.0 - <4p 4p> = .7683E-06

1.0 - <2p 2p> = -.6229E-09

1.0 - <2s 2s> = .1367E-07

1.0 - <1s 1s> = -.7615E-08

<4p 2p> = -.8438E-07

<2s 1s> = .4866E-06

RETURN