(1s 2 2s 2 2p 2 5p 1 ) 2 S Ar 11+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2051.
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 | 5.335298 | .38503472 |
| 2 | 3p | 2.859529 | -3.49593112 |
| 3 | 4p | 2.574730 | 8.24699359 |
| 4 | 5p | 2.512406 | -5.72580379 |
| 5 | 2p | 10.803724 | .04383648 |
| 6 | 5p | 34.235583 | -.00057470 |
| 7 | 4p | 50.106238 | -.00014134 |
| 8 | 5p | 1.980862 | -.02117430 |
| ORB.ENERGY,a.u. | -3.097300 | ||
| NORM | 1.000002 | < R > | 2.833338 | < R2 > | 9.027574 | < 1/R > | .510847 | < 1/R**2 > | .915662 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.200163 | 1.13323745 |
| 2 | 3p | 8.210606 | -.15953812 |
| 3 | 2p | 16.739343 | .02350019 |
| 4 | 4p | 19.379690 | .00680944 |
| 5 | 5p | 29.378010 | -.00070942 |
| 6 | 5p | 7.768055 | -.00406497 |
| 7 | 4p | 76.379666 | .00002713 |
| ORB.ENERGY,a.u. | -24.747000 | ||
| NORM | 1.000000 | < R > | .328269 | < R2 > | .130574 | < 1/R > | 3.854838 | < 1/R**2 > | 20.129317 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.057742 | .43783381 |
| 2 | 2s | 7.994621 | -.87212144 |
| 3 | 3s | 8.204197 | -.28697552 |
| 4 | 4s | 30.541755 | .00185835 |
| 5 | 3s | 16.491173 | .01691015 |
| 6 | 5s | 8.275236 | -.02079512 |
| ORB.ENERGY,a.u. | -23.662000 | ||
| NORM | 1.000000 | < R > | .378521 | < R2 > | .167777 | < 1/R > | 3.884012 | < 1/R**2 > | 61.146536 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.067563 | .92683796 |
| 2 | 1s | 25.713461 | .07171627 |
| 3 | 2s | 15.745421 | .01938324 |
| 4 | 3s | 19.683254 | -.01555179 |
| 5 | 5s | 42.296051 | .00077984 |
| 6 | 4s | 99.833515 | -.00003501 |
| 7 | 5s | 12.802138 | .00020925 |
| ORB.ENERGY,a.u. | -133.590000 |
| NORM | 1.000000 | < R > | .085568 | < R2 > | .009809 | < 1/R > | 17.623337 | < 1/R**2 > | 624.983045 |
Total Energy= -433.46551708 a.u.
Kinetic Energy= 433.49179530 a.u.
Potential Energy= -866.95731237 a.u.
Virial Ratio = -1.99993938