(1s 2 2s 2 2p 2 5p 1 ) 2 P Ar 11+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2151.
N.V.Novikov // Wave Function Value Database;
http://cdfe.sinp.msu.ru/services/wftables/
j | S nl j (α j ,r) | C j | |
nl j | α j | 5p- electron | |
1 | 2p | 4.632820 | .47924165 |
2 | 3p | 2.859522 | -3.67078881 |
3 | 4p | 2.548917 | 8.23283663 |
4 | 5p | 2.469755 | -5.66138234 |
5 | 2p | 11.402802 | .03702812 |
6 | 5p | 48.856271 | -.00014798 |
7 | 4p | 88.448001 | -.00001433 |
ORB.ENERGY,a.u. | -3.040800 |
NORM | 1.000000 | < R > | 2.883114 | < R2 > | 9.349061 | < 1/R > | .494341 | < 1/R**2 > | .807263 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 2p- electron | |
1 | 2p | 7.510308 | 1.19580654 |
2 | 3p | 9.597860 | -.23985727 |
3 | 4p | 11.614158 | .04407872 |
4 | 5p | 3.058883 | .06533882 |
5 | 4p | 2.299680 | -.06568868 |
6 | 5p | 32.199482 | -.00161053 |
7 | 4p | 41.526014 | -.00082435 |
8 | 3p | 58.803834 | -.00006657 |
ORB.ENERGY,a.u. | -24.690000 |
NORM | 1.000000 | < R > | .327893 | < R2 > | .130978 | < 1/R > | 3.860493 | < 1/R**2 > | 20.180166 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 2s- electron | |
1 | 1s | 14.057697 | .43784074 |
2 | 2s | 7.994558 | -.87214328 |
3 | 3s | 8.205753 | -.28697737 |
4 | 4s | 30.554521 | .00186037 |
5 | 3s | 16.474900 | .01696242 |
6 | 5s | 8.269638 | -.02083940 |
ORB.ENERGY,a.u. | -23.662000 |
NORM | 1.000000 | < R > | .378519 | < R2 > | .167776 | < 1/R > | 3.884046 | < 1/R**2 > | 61.147784 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 1s- electron | |
1 | 1s | 17.067563 | .92683816 |
2 | 1s | 25.713461 | .07171629 |
3 | 2s | 15.745015 | .01938292 |
4 | 3s | 19.683257 | -.01555181 |
5 | 5s | 42.309011 | .00077960 |
6 | 4s | 99.809496 | -.00003490 |
7 | 5s | 12.832519 | .00021036 |
ORB.ENERGY,a.u. | -133.590000 |
NORM | 1.000000 | < R > | .085568 | < R2 > | .009809 | < 1/R > | 17.623338 | < 1/R**2 > | 624.983178 |
Total Energy= -433.46492371 a.u.
Kinetic Energy= 433.43558595 a.u.
Potential Energy= -866.90050966 a.u.
Virial Ratio = -2.00006769