RETURN

(1s 2 2s 2 2p 4 5s 1 ) 2 P             Ar 9+

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

Table 2150.

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 5s- electron
1 1s 14.252421 .07434198
2 2s 4.939034 -.48026826
3 3s 2.659378 3.12219264
4 4s 2.433541 -5.72124636
5 5s 2.150664 3.55497850
6 5s 18.603119 -.00363016
7 4s 24.017022 -.00098357
8 5s 39.965454 .00016555
ORB.ENERGY,a.u. -2.323900
NORM 1.000004
< R > 3.240787
< R2 > 11.753279
< 1/R > .442882
< 1/R**2 > 1.916299


j S nl j j ,r) C j
nl j α j 2p- electron
1 2p 6.506539 1.12765980
2 3p 7.258624 -.20430238
3 2p 13.752631 .07157772
4 4p 16.508860 .01284819
5 5p 20.301700 -.00057855
6 5p 6.315861 -.00131563
7 4p 72.090475 .00002303
ORB.ENERGY,a.u. -19.317000
NORM 1.000000
< R > .347882
< R2 > .147747
< 1/R > 3.669787
< 1/R**2 > 18.427451


j S nl j j ,r) C j
nl j α j 2s- electron
1 1s 15.449411 .36547420
2 2s 6.899783 -.78259472
3 3s 9.821241 -.24117984
4 4s 7.816817 -.07005233
5 5s 21.137894 -.00798393
6 5s 3.098049 -.00886633
7 3s 3.395856 .00453251
8 3s 65.238266 -.00007490
9 4s 116.630735 .00001319
10 4s 1.792479 .00690890
ORB.ENERGY,a.u. -20.023000
NORM 1.000000
< R > .392814
< R2 > .181422
< 1/R > 3.734694
< 1/R**2 > 56.898266


j S nl j j ,r) C j
nl j α j 1s- electron
1 1s 17.133350 .92065570
2 1s 24.676720 .07565784
3 2s 11.575531 .02021313
4 3s 13.985286 -.01977030
5 4s 16.499562 .00848524
6 5s 44.494943 .00057576
7 3s 63.277996 -.00007681
8 5s 1.875324 -.00544438
9 4s 1.672196 .00644710
10 3s 1.846083 -.00135805
ORB.ENERGY,a.u. -127.520000
NORM 1.000000
< R > .085844
< R2 > .009887
< 1/R > 17.587025
< 1/R**2 > 622.983236


Total Energy= -475.24422779 a.u.

Kinetic Energy= 475.23442316 a.u.

Potential Energy= -950.47865096 a.u.

Virial Ratio = -2.00002063

***** TESTING *****

1.0 - <5s 5s> = -.3531E-05

1.0 - <2p 2p> = -.1166E-08

1.0 - <2s 2s> = .1361E-07

1.0 - <1s 1s> = -.4898E-08

<5s 2s> = -.1137E-06

<5s 1s> = -.4749E-06

<2s 1s> = .4275E-07

RETURN