(1s 2 2s 2 2p 2 3s 1 ) 4 P N 0
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4130.
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 | 3s- electron | |
| 1 | 3s | .658078 | .87500187 |
| 2 | 4s | 4.504331 | -.02897755 |
| 3 | 5s | 7.939632 | -.00463148 |
| 4 | 4s | 1.175810 | .12603171 |
| 5 | 5s | .608854 | .04838631 |
| 6 | 1s | 6.200980 | .06149751 |
| 7 | 2s | 2.018072 | -.22889062 |
| ORB.ENERGY,a.u. | -.144350 | ||
| NORM | 1.000000 | < R > | 5.313841 | < R2 > | 32.549905 | < 1/R > | .245830 | < 1/R**2 > | .317287 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 1.752461 | .70571398 |
| 2 | 2p | 2.942165 | .28805082 |
| 3 | 2p | 6.766194 | .01639404 |
| 4 | 3p | 1.234550 | .03620178 |
| 5 | 2p | 5.413643 | .00791068 |
| 6 | 5p | 8.029458 | .00456111 |
| 7 | 4p | .548082 | .00046677 |
| 8 | 3p | 10.776362 | -.00018458 |
| ORB.ENERGY,a.u. | -.817320 | ||
| NORM | 1.000000 | < R > | 1.252942 | < R2 > | 1.969809 | < 1/R > | 1.051142 | < 1/R**2 > | 1.568892 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 5.915192 | .28402518 |
| 2 | 2s | 2.423358 | -.84170473 |
| 3 | 3s | 1.933017 | -.26934692 |
| 4 | 4s | 8.371525 | .01275993 |
| 5 | 3s | 8.173072 | .01369240 |
| 6 | 5s | 1.136279 | -.02295398 |
| 7 | 4s | .644532 | -.04182330 |
| 8 | 5s | 18.386650 | .00044574 |
| 9 | 3s | .579206 | .05025503 |
| ORB.ENERGY,a.u. | -.654320 | ||
| NORM | 1.000000 | < R > | 1.261678 | < R2 > | 1.914381 | < 1/R > | 1.136266 | < 1/R**2 > | 5.253217 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 6.230790 | .71805906 |
| 2 | 1s | 9.299198 | .22524683 |
| 3 | 1s | 2.574277 | .00429710 |
| 4 | 2s | 6.891047 | .08376124 |
| 5 | 3s | 7.773583 | -.02142186 |
| 6 | 4s | 12.762583 | .00674515 |
| 7 | 5s | 1.104808 | .00037509 |
| 8 | 5s | 28.550269 | .00014470 |
| ORB.ENERGY,a.u. | -15.024000 |
| NORM | 1.000000 | < R > | .228073 | < R2 > | .070087 | < 1/R > | 6.656899 | < 1/R**2 > | 89.914000 |
Total Energy= -54.02823141 a.u.
Kinetic Energy= 54.03230613 a.u.
Potential Energy= -108.06053755 a.u.
Virial Ratio = -1.99992459